##TITLE=1000331
##JCAMP-DX=4.24
##DATA TYPE=RAMAN SPECTRUM
##SOURCE REFERENCE=http://solsa.crystallography.net/rod/1000331.rod
##OWNER=PUBLIC DOMAIN
##XUNITS=1/CM
##YUNITS=ARBITRARY UNITS
##FIRSTX=160.7149
##LASTX=1301.885
##XFACTOR=1
##YFACTOR=1
##NPOINTS=2368
##FIRSTY=0.0000000E+00
##LASTY=0.0000000E+00
##XYPOINTS=(XY..XY)
160.7149,0.0000000E+00 161.1970,0.1022470 161.6791,0.2358680 
162.1613,0.3758510 162.6434,0.5354210 163.1255,0.3028760 163.6076,0.1449450 
164.0897,2.3740999E-02 164.5718,9.1319002E-02 165.0540,0.1775220 
165.5361,0.1520970 166.0182,2.0147000E-02 166.5003,8.6090997E-02 
166.9824,6.7630000E-02 167.4645,1.0714000E-02 167.9467,6.6869996E-02 
168.4288,4.2932000E-02 168.9109,5.4629999E-03 169.3930,2.7170000E-03 
169.8751,2.0529000E-02 170.3572,6.6427000E-02 170.8394,0.1226950 
171.3215,0.1998210 171.8036,0.3125670 172.2857,0.4352520 172.7678,0.6146760 
173.2499,0.9466270 173.7321,1.465829 174.2142,1.940001 174.6963,2.166358 
175.1784,2.205375 175.6605,2.200307 176.1426,2.170485 176.6248,2.156403 
177.1069,2.237185 177.5890,2.442515 178.0711,2.647920 178.5532,2.723688 
179.0353,2.688356 179.5175,2.602710 179.9996,2.413915 180.4817,2.210452 
180.9638,2.183196 181.4459,2.387973 181.9280,2.683535 182.4102,2.897904 
182.8923,3.036393 183.3744,3.167360 183.8565,3.295636 184.3386,3.445040 
184.8207,3.690162 185.3029,4.068493 185.7850,4.500671 186.2671,4.877805 
186.7492,5.198711 187.2313,5.480266 187.7134,5.693173 188.1956,5.864243 
188.6777,6.122282 189.1598,6.524778 189.6419,6.984243 190.1240,7.283531 
190.6061,7.419167 191.0883,7.580362 191.5704,7.935753 192.0525,8.469997 
192.5346,9.006081 193.0167,9.536189 193.4988,10.01609 193.9810,10.24098 
194.4631,10.16975 194.9452,10.08490 195.4273,10.09225 195.9094,10.18926 
196.3915,10.41992 196.8737,10.85584 197.3558,11.40272 197.8379,11.71290 
198.3200,11.75640 198.8021,11.71272 199.2842,11.69803 199.7664,11.70566 
200.2485,11.85106 200.7306,12.23839 201.2127,12.78736 201.6948,12.99724 
202.1769,12.78397 202.6591,12.50808 203.1412,12.53963 203.6233,12.92063 
204.1054,13.26893 204.5875,13.48471 205.0696,13.58739 205.5518,13.75410 
206.0339,13.99962 206.5160,14.27314 206.9981,14.52063 207.4802,14.73054 
207.9623,14.95496 208.4445,15.20995 208.9266,15.49498 209.4087,15.78357 
209.8908,16.10901 210.3729,16.38439 210.8550,16.46780 211.3372,16.26677 
211.8193,16.20161 212.3014,16.43675 212.7835,16.95374 213.2656,17.31348 
213.7477,17.49531 214.2299,17.55340 214.7120,17.53276 215.1941,17.36843 
215.6762,17.26326 216.1583,17.34021 216.6404,17.57440 217.1226,17.63609 
217.6047,17.51628 218.0868,17.25678 218.5689,16.87455 219.0510,16.30454 
219.5331,15.80749 220.0153,15.44674 220.4974,15.22922 220.9795,15.05836 
221.4616,14.95163 221.9437,14.82879 222.4258,14.62844 222.9080,14.34780 
223.3901,14.01512 223.8722,13.65084 224.3543,13.24849 224.8364,12.79100 
225.3185,12.20147 225.8007,11.60886 226.2828,11.20047 226.7649,11.08482 
227.2470,10.95728 227.7291,10.74401 228.2112,10.43990 228.6934,10.07665 
229.1755,9.596460 229.6576,9.106802 230.1397,8.763462 230.6218,8.637331 
231.1039,8.523483 231.5861,8.391607 232.0682,8.255037 232.5503,7.993982 
233.0324,7.534527 233.5145,7.015959 233.9966,6.607714 234.4788,6.345572 
234.9609,6.135546 235.4430,5.960667 235.9251,5.824644 236.4072,5.702770 
236.8893,5.623417 237.3715,5.534658 237.8536,5.360939 238.3357,5.026033 
238.8178,4.737196 239.2999,4.561432 239.7820,4.520121 240.2642,4.430075 
240.7463,4.253906 241.2284,4.059528 241.7105,3.934065 242.1926,3.916489 
242.6747,3.897078 243.1569,3.859261 243.6390,3.807634 244.1211,3.690899 
244.6032,3.474127 245.0853,3.223072 245.5674,3.008402 246.0496,2.818480 
246.5317,2.689182 247.0138,2.652895 247.4959,2.724770 247.9780,2.715225 
248.4601,2.597708 248.9423,2.427097 249.4244,2.256392 249.9065,2.067135 
250.3886,1.914738 250.8707,1.810337 251.3528,1.754684 251.8350,1.746597 
252.3171,1.816801 252.7992,1.900646 253.2813,1.939341 253.7634,1.946213 
254.2455,1.874689 254.7277,1.691542 255.2098,1.393221 255.6919,1.128382 
256.1740,0.8603900 256.6561,0.6700460 257.1382,0.6693150 257.6204,0.9786190 
258.1025,1.181339 258.5846,1.166677 259.0667,0.9475480 259.5488,0.7843130 
260.0309,0.6619280 260.5131,0.6206050 260.9952,0.7574040 261.4773,1.236677 
261.9594,1.413668 262.4415,1.038887 262.9236,0.1977560 263.4058,0.1468260 
263.8879,0.2217450 264.3700,0.7140240 264.8521,0.8229450 265.3342,0.3790950 
265.8163,0.1404990 266.2985,0.3190040 266.7806,0.8034110 267.2627,0.9040550 
267.7448,0.4520110 268.2269,3.1736001E-02 268.7090,9.5316000E-02 
269.1912,0.4183850 269.6733,0.6561870 270.1554,0.4322050 270.6375,0.1236190 
271.1196,0.4926830 271.6017,0.6523170 272.0839,0.6893060 272.5660,0.6335450 
273.0481,0.4673310 273.5302,0.3241120 274.0123,0.2185860 274.4944,0.1412110 
274.9766,4.3922000E-02 275.4587,9.5937997E-02 275.9408,0.1693440 
276.4229,7.5680003E-02 276.9050,0.2025950 277.3871,0.4400160 
277.8693,0.6481170 278.3514,0.7764510 278.8335,0.6430930 279.3156,0.1903930 
279.7977,0.1921230 280.2798,0.2513850 280.7620,1.5001000E-02 
281.2441,0.2524030 281.7262,0.4609830 282.2083,0.6049540 282.6904,0.5892510 
283.1725,0.4034210 283.6547,0.2107320 284.1368,0.1007560 
284.6189,6.5696999E-02 285.1010,1.0473000E-02 285.5831,0.1421300 
286.0652,0.2815480 286.5474,0.3500940 287.0295,0.3492110 287.5116,0.3499390 
287.9937,0.3783840 288.4758,0.4340670 288.9579,0.5292530 289.4401,0.6779990 
289.9222,0.8021350 290.4043,0.7588230 290.8864,0.5740780 291.3685,0.4581220 
291.8506,0.5150340 292.3328,0.6975330 292.8149,0.8982510 293.2970,1.125105 
293.7791,1.290154 294.2612,1.241781 294.7433,1.035204 295.2255,0.8900620 
295.7076,0.8900030 296.1897,0.9907210 296.6718,1.110861 297.1539,1.249933 
297.6360,1.420965 298.1182,1.665304 298.6003,1.950178 299.0824,2.198795 
299.5645,2.382738 300.0466,2.529560 300.5287,2.673735 301.0109,2.814701 
301.4930,2.953732 301.9751,3.100145 302.4572,3.242771 302.9393,3.336666 
303.4214,3.312532 303.9036,3.350187 304.3857,3.738096 304.8678,4.382692 
305.3499,4.949991 305.8320,5.129410 306.3141,5.153959 306.7963,5.276262 
307.2784,5.518806 307.7605,5.924377 308.2426,6.726114 308.7247,7.736397 
309.2068,8.505276 309.6890,8.531654 310.1711,8.372570 310.6532,8.541178 
311.1353,9.150043 311.6174,9.782209 312.0995,10.12372 312.5817,10.31299 
313.0638,10.57877 313.5459,11.12284 314.0280,11.69412 314.5101,12.16525 
314.9922,12.52789 315.4744,12.76595 315.9565,12.70736 316.4386,12.57245 
316.9207,12.61200 317.4028,12.96438 317.8849,13.45139 318.3671,14.11291 
318.8492,14.93283 319.3313,15.54018 319.8134,15.57342 320.2955,15.46928 
320.7776,15.57483 321.2598,15.95522 321.7419,16.56127 322.2240,17.52503 
322.7061,18.75810 323.1882,19.80385 323.6703,20.42083 324.1525,20.93516 
324.6346,21.51307 325.1167,22.12075 325.5988,22.86854 326.0809,23.80862 
326.5630,24.89765 327.0452,26.02799 327.5273,27.35469 328.0094,28.56005 
328.4915,29.50764 328.9736,30.02543 329.4557,30.62392 329.9379,31.35600 
330.4200,32.16695 330.9021,32.93881 331.3842,33.44866 331.8663,34.22067 
332.3484,35.50329 332.8306,37.39641 333.3127,38.96548 333.7948,39.97823 
334.2769,40.87401 334.7590,42.12867 335.2411,43.89477 335.7233,45.69738 
336.2054,47.42405 336.6875,49.11018 337.1696,50.86274 337.6517,52.59523 
338.1339,54.51144 338.6160,56.78566 339.0981,59.47643 339.5802,62.25779 
340.0623,65.06678 340.5444,67.95347 341.0266,70.91962 341.5087,74.02157 
341.9908,77.11334 342.4729,80.14153 342.9550,83.08064 343.4371,86.04523 
343.9193,89.06374 344.4014,92.01751 344.8835,94.78130 345.3656,97.35175 
345.8477,99.30413 346.3298,100.4243 346.8120,100.7583 347.2941,100.4492 
347.7762,99.49638 348.2583,97.91859 348.7404,95.67535 349.2225,92.80692 
349.7047,89.46384 350.1868,85.43002 350.6689,81.09737 351.1510,77.09381 
351.6331,73.43210 352.1152,69.89511 352.5974,66.25473 353.0795,62.61594 
353.5616,59.16078 354.0437,55.88026 354.5258,52.89180 355.0079,50.35498 
355.4901,48.22445 355.9722,46.24088 356.4543,44.09266 356.9364,42.09156 
357.4185,40.56207 357.9006,39.64451 358.3828,38.96868 358.8649,38.38011 
359.3470,37.84448 359.8291,37.31687 360.3112,36.68843 360.7933,36.13792 
361.2755,35.78882 361.7576,35.66214 362.2397,35.57264 362.7218,35.42362 
363.2039,35.29051 363.6860,35.25746 364.1682,35.43783 364.6503,35.64446 
365.1324,35.82139 365.6145,35.96534 366.0966,36.09398 366.5787,36.24677 
367.0609,36.36329 367.5430,36.40070 368.0251,36.27595 368.5072,36.14945 
368.9893,36.08677 369.4714,36.04435 369.9536,35.86707 370.4357,35.41035 
370.9178,34.97951 371.3999,34.72174 371.8820,34.77806 372.3641,34.61317 
372.8463,34.20308 373.3284,33.62315 373.8105,32.90717 374.2926,31.90989 
374.7747,31.04770 375.2568,30.52113 375.7390,30.34098 376.2211,29.84848 
376.7032,28.96110 377.1853,27.93502 377.6674,26.96086 378.1495,26.02668 
378.6317,25.15603 379.1138,24.37772 379.5959,23.66334 380.0780,22.85419 
380.5601,21.94279 381.0422,21.04864 381.5244,20.27109 382.0065,19.58118 
382.4886,18.90332 382.9707,18.24705 383.4528,17.50229 383.9349,16.35208 
384.4171,14.89861 384.8992,13.67618 385.3813,13.10134 385.8634,12.86700 
386.3455,12.40087 386.8276,11.66430 387.3098,10.91928 387.7919,10.43840 
388.2740,10.09529 388.7561,9.657640 389.2382,8.916290 389.7203,8.141422 
390.2025,7.553219 390.6846,7.136421 391.1667,6.798065 391.6488,6.601706 
392.1309,6.403225 392.6130,6.054062 393.0952,5.436005 393.5773,4.886953 
394.0594,4.603880 394.5415,4.484331 395.0236,4.333615 395.5057,4.066255 
395.9879,3.779747 396.4700,3.488348 396.9521,3.177825 397.4342,2.968235 
397.9163,3.026541 398.3984,3.123041 398.8806,3.048123 399.3627,2.571653 
399.8448,2.170441 400.3269,1.906578 400.8090,1.766951 401.2911,1.669111 
401.7733,1.679651 402.2554,1.652244 402.7375,1.484089 403.2196,1.042754 
403.7017,0.8052610 404.1838,0.8496040 404.6660,1.046210 405.1481,1.166620 
405.6302,1.215581 406.1123,1.169940 406.5944,0.9718380 407.0765,0.6339030 
407.5587,0.4661790 408.0408,0.4925770 408.5229,0.5915460 409.0050,0.6740630 
409.4871,0.7348160 409.9692,0.6929030 410.4514,0.4872120 410.9335,0.2168740 
411.4156,9.2882998E-02 411.8977,0.1073820 412.3798,0.1540480 
412.8619,0.1944760 413.3441,0.2120300 413.8262,0.1578670 
414.3083,1.2410000E-02 414.7904,0.1353590 415.2725,0.2267650 
415.7546,0.2566210 416.2368,0.2169070 416.7189,8.6970003E-03 
417.2010,0.2257600 417.6831,0.2406660 418.1652,6.4346001E-02 
418.6473,8.2647003E-02 419.1295,5.0949998E-02 419.6116,5.0138000E-02 
420.0937,0.1273980 420.5758,0.1783910 421.0579,0.1743120 
421.5400,6.9868997E-02 422.0222,9.7207002E-02 422.5043,0.2375980 
422.9864,0.3209690 423.4685,0.3807280 423.9506,0.4368310 424.4327,0.5052980 
424.9149,0.5151090 425.3970,0.4194620 425.8791,0.2894100 426.3612,0.1926370 
426.8433,0.1327630 427.3254,0.1039620 427.8076,0.1237870 428.2897,0.1805730 
428.7718,0.1726250 429.2539,4.9192999E-02 429.7360,3.6258999E-02 
430.2181,5.5022001E-02 430.7003,0.3760790 431.1824,0.5017780 
431.6645,0.3670800 432.1466,0.1130340 432.6287,3.5300002E-02 
433.1108,7.6113001E-02 433.5930,6.3432001E-02 434.0751,1.8270001E-02 
434.5572,0.1330050 435.0393,0.1335440 435.5214,1.6439000E-02 
436.0035,8.7770998E-02 436.4857,4.2311002E-02 436.9678,0.1048660 
437.4499,0.2445940 437.9320,0.3622250 438.4141,0.4457650 438.8962,0.4911670 
439.3784,0.4934130 439.8605,0.4374870 440.3426,0.2663780 
440.8247,6.4878002E-02 441.3068,0.1194620 441.7889,0.2858670 
442.2711,0.3703990 442.7532,0.2248130 443.2353,2.7585000E-02 
443.7174,3.5983998E-02 444.1995,0.3142820 444.6816,0.5645320 
445.1638,0.4719230 445.6459,0.1265050 446.1280,5.8635999E-02 
446.6101,0.1213480 447.0922,0.3540100 447.5743,0.5067390 448.0565,0.5451320 
448.5386,0.5861020 449.0207,0.6643150 449.5028,0.7230640 449.9849,0.6546160 
450.4670,0.3108950 450.9492,0.1897350 451.4313,0.5068840 451.9134,1.167557 
452.3955,1.418180 452.8776,1.153856 453.3597,0.8304230 453.8419,0.7786110 
454.3240,0.9915230 454.8061,1.172008 455.2882,1.295255 455.7703,1.376354 
456.2524,1.345517 456.7346,1.245132 457.2167,1.360802 457.6988,2.117724 
458.1809,3.033911 458.6630,3.152303 459.1451,2.517799 459.6273,1.867193 
460.1094,1.800403 460.5915,2.041480 461.0736,2.233315 461.5557,2.274638 
462.0378,2.308181 462.5200,2.457804 463.0021,2.664886 463.4842,2.812140 
463.9663,2.720919 464.4484,2.675739 464.9305,2.858414 465.4127,3.293224 
465.8948,3.645887 466.3769,3.784329 466.8590,3.852697 467.3411,3.953955 
467.8232,4.103048 468.3054,4.276683 468.7875,4.480318 469.2696,4.703573 
469.7517,4.931908 470.2338,5.181431 470.7159,5.400800 471.1981,5.538706 
471.6802,5.585146 472.1623,5.807058 472.6444,6.238997 473.1265,6.727324 
473.6086,7.117958 474.0908,7.416557 474.5729,7.721601 475.0550,8.053938 
475.5371,8.365865 476.0192,8.592399 476.5013,8.725973 476.9835,8.752341 
477.4656,8.604816 477.9477,8.362734 478.4298,8.170787 478.9119,8.036212 
479.3940,7.868538 479.8762,7.569536 480.3583,7.195477 480.8404,6.817247 
481.3225,6.402744 481.8046,6.058834 482.2867,5.869377 482.7689,5.798286 
483.2510,5.749533 483.7331,5.615263 484.2152,5.562588 484.6973,5.687665 
485.1794,6.033273 485.6616,6.354649 486.1437,6.618988 486.6258,6.858718 
487.1079,7.098925 487.5900,7.288179 488.0721,7.550238 488.5543,7.868423 
489.0364,8.267595 489.5185,8.826964 490.0006,9.598441 490.4827,10.36959 
490.9648,10.97073 491.4470,11.42179 491.9291,12.18538 492.4112,13.29580 
492.8933,14.52939 493.3754,15.59929 493.8575,16.57775 494.3397,17.80021 
494.8218,19.39431 495.3039,21.12124 495.7860,22.67114 496.2681,24.06687 
496.7502,25.37457 497.2324,26.60238 497.7145,27.79922 498.1966,29.13874 
498.6787,30.64200 499.1608,31.76365 499.6429,32.19016 500.1251,32.11963 
500.6072,31.73790 501.0893,31.11496 501.5714,30.13964 502.0535,28.72503 
502.5356,26.94584 503.0178,24.98339 503.4999,22.58520 503.9820,20.24415 
504.4641,18.10131 504.9462,16.15129 505.4283,14.35429 505.9105,12.69996 
506.3926,11.23217 506.8747,10.01082 507.3568,9.066479 507.8389,8.182643 
508.3210,7.358531 508.8032,6.576419 509.2853,5.778780 509.7674,4.971292 
510.2495,4.310160 510.7316,3.926182 511.2137,3.697001 511.6959,3.308657 
512.1780,2.782305 512.6601,2.354354 513.1422,2.352467 513.6243,2.490743 
514.1064,2.353845 514.5886,1.778702 515.0707,1.261040 515.5528,1.200146 
516.0349,1.368524 516.5170,1.435774 516.9991,1.163407 517.4813,0.9101690 
517.9634,0.8242450 518.4455,0.8830600 518.9276,0.8817840 519.4097,0.7228380 
519.8918,0.5643860 520.3740,0.4749270 520.8561,0.4816810 521.3382,0.4606320 
521.8203,0.3817810 522.3024,0.3093370 522.7845,0.3271130 523.2667,0.4521000 
523.7488,0.5741000 524.2309,0.6792020 524.7130,0.7594900 525.1951,0.7920730 
525.6772,0.7774460 526.1594,0.7387650 526.6415,0.6667040 527.1236,0.5840240 
527.6057,0.5560940 528.0878,0.5859750 528.5699,0.6062030 529.0521,0.5163200 
529.5342,0.3984610 530.0163,0.3613600 530.4984,0.4435530 530.9805,0.5941900 
531.4626,0.8579170 531.9448,1.163341 532.4269,1.371120 532.9090,1.322703 
533.3911,1.287238 533.8732,1.375645 534.3553,1.596021 534.8375,1.765951 
535.3196,1.855321 535.8017,1.917019 536.2838,1.954595 536.7659,1.883730 
537.2480,2.051756 537.7302,2.543023 538.2123,3.160378 538.6944,3.595034 
539.1765,3.837133 539.6586,4.091438 540.1407,4.413077 540.6229,4.779608 
541.1050,5.078376 541.5871,5.327915 542.0692,5.711542 542.5513,6.522758 
543.0334,7.480751 543.5156,8.100025 543.9977,8.337127 544.4798,8.580229 
544.9619,9.074283 545.4440,9.736114 545.9261,10.46184 546.4083,11.24549 
546.8904,12.05899 547.3725,12.89015 547.8546,13.74713 548.3367,14.64643 
548.8188,15.62028 549.3010,16.59502 549.7831,17.55095 550.2652,18.48779 
550.7473,19.46150 551.2294,20.56804 551.7115,21.54810 552.1937,22.20929 
552.6758,22.51039 553.1579,22.90222 553.6400,23.46926 554.1221,23.95623 
554.6042,24.00890 555.0864,23.66141 555.5685,23.10864 556.0506,22.42365 
556.5327,21.56027 557.0148,20.36413 557.4969,18.90770 557.9791,17.45911 
558.4612,16.19781 558.9433,15.00034 559.4254,13.78550 559.9075,12.54087 
560.3896,11.31328 560.8718,10.06842 561.3539,8.894201 561.8360,7.857904 
562.3181,6.952900 562.8002,6.214260 563.2823,5.716523 563.7645,5.348356 
564.2466,4.937669 564.7287,4.440837 565.2108,4.012041 565.6929,3.699286 
566.1750,3.481594 566.6572,3.246409 567.1393,2.988969 567.6214,2.757048 
568.1035,2.583038 568.5856,2.457783 569.0677,2.338713 569.5499,2.224730 
570.0320,2.126549 570.5141,2.071950 570.9962,2.036896 571.4783,1.975493 
571.9604,1.848967 572.4426,1.750051 572.9247,1.716839 573.4068,1.754738 
573.8889,1.872567 574.3710,2.254875 574.8531,2.535238 575.3353,2.505022 
575.8174,2.194131 576.2995,2.066306 576.7816,2.219877 577.2637,2.455452 
577.7458,2.718168 578.2280,3.038807 578.7101,3.201907 579.1922,3.174452 
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581.6028,2.934937 582.0849,3.129587 582.5670,3.228938 583.0491,3.235027 
583.5313,3.156939 584.0134,2.945079 584.4955,2.689156 584.9776,2.460280 
585.4597,2.257387 585.9418,2.070901 586.4240,1.848524 586.9061,1.678742 
587.3882,1.622504 587.8703,1.716082 588.3524,1.809452 588.8345,1.864121 
589.3167,1.925586 589.7988,2.035973 590.2809,2.238661 590.7630,2.386621 
591.2451,2.449887 591.7272,2.474488 592.2094,2.549247 592.6915,2.676459 
593.1736,2.812853 593.6557,2.960503 594.1378,3.096602 594.6199,3.181627 
595.1021,3.211718 595.5842,3.159543 596.0663,2.924450 596.5484,2.640832 
597.0305,2.484394 597.5126,2.474245 597.9948,2.442185 598.4769,2.321132 
598.9590,2.122805 599.4411,1.848494 599.9232,1.421517 600.4053,1.044499 
600.8875,0.7826460 601.3696,0.5774960 601.8517,0.3381960 
602.3338,2.2147000E-02 602.8159,0.2273430 603.2980,0.1585240 
603.7802,7.9439998E-02 604.2623,7.0744999E-02 604.7444,0.2151140 
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607.1550,0.4892630 607.6371,0.5507000 608.1192,0.4873400 608.6013,0.3757140 
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611.0119,7.2050001E-03 611.4940,0.1330910 611.9761,1.4897000E-02 
612.4583,3.8596999E-02 612.9404,4.2190000E-02 613.4225,0.2146590 
613.9046,0.3929830 614.3867,0.5818580 614.8688,0.7452990 615.3510,0.8674720 
615.8331,0.9596890 616.3152,1.104528 616.7973,1.308946 617.2794,1.474016 
617.7615,1.488101 618.2437,1.414504 618.7258,1.423258 619.2079,1.515991 
619.6900,1.663089 620.1721,1.841955 620.6542,2.062978 621.1364,2.346807 
621.6185,2.735704 622.1006,3.110107 622.5827,3.417148 623.0648,3.681944 
623.5469,3.939621 624.0291,4.158682 624.5112,4.418953 624.9933,4.763401 
625.4754,5.157454 625.9575,5.452457 626.4396,5.585873 626.9218,5.811899 
627.4039,6.283710 627.8860,6.938999 628.3681,7.399469 628.8502,7.663937 
629.3323,7.821337 629.8145,7.909946 630.2966,7.939628 630.7787,7.949108 
631.2608,7.945391 631.7429,7.855843 632.2250,7.575370 632.7072,7.206745 
633.1893,6.850648 633.6714,6.536766 634.1535,6.232426 634.6356,5.952907 
635.1177,5.673466 635.5999,5.348623 636.0820,4.960604 636.5641,4.551129 
637.0462,4.093172 637.5283,3.633506 638.0104,3.312882 638.4926,3.136897 
638.9747,3.005163 639.4568,2.891720 639.9389,2.780167 640.4210,2.596541 
640.9031,2.341248 641.3853,2.108535 641.8674,1.979405 642.3495,1.904984 
642.8316,1.834550 643.3137,1.762234 643.7958,1.688581 644.2780,1.608653 
644.7601,1.528111 645.2422,1.453859 645.7243,1.398812 646.2064,1.336325 
646.6885,1.246179 647.1707,1.149976 647.6528,1.084437 648.1349,1.066335 
648.6170,1.018193 649.0991,0.9052910 649.5812,0.7752430 650.0634,0.7599480 
650.5455,0.8497310 651.0276,0.9110410 651.5097,0.8776510 651.9918,0.7814840 
652.4739,0.6322710 652.9561,0.4502200 653.4382,0.3318600 653.9203,0.3888000 
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656.3309,0.5812340 656.8130,0.6039960 657.2951,0.5841340 657.7772,0.4920430 
658.2593,0.4379230 658.7415,0.4301720 659.2236,0.4486020 659.7057,0.4750320 
660.1878,0.5081610 660.6699,0.5372100 661.1520,0.5858840 661.6342,0.6040850 
662.1163,0.4449970 662.5984,0.1781640 663.0805,5.3940001E-03 
663.5626,0.1030280 664.0447,0.2545100 664.5269,0.3112950 665.0090,0.2878680 
665.4911,0.2397300 665.9732,0.2042180 666.4553,0.1424880 
666.9374,1.4242000E-02 667.4196,0.2563340 667.9017,0.3262180 
668.3838,0.1216580 668.8659,8.8365003E-02 669.3480,0.1518940 
669.8301,6.9891997E-02 670.3123,1.7150000E-03 670.7944,5.0144002E-02 
671.2765,7.1291000E-02 671.7586,2.4529001E-02 672.2407,6.0089000E-02 
672.7228,0.1075510 673.2050,0.1028410 673.6871,0.1037490 674.1692,0.1939390 
674.6513,0.2976260 675.1334,0.3186700 675.6155,0.1313230 
676.0977,1.3132000E-02 676.5798,8.1120998E-02 677.0619,0.2380460 
677.5440,0.3421720 678.0261,0.3790870 678.5082,0.3921380 678.9904,0.3826760 
679.4725,0.3582680 679.9546,0.3355720 680.4367,0.3158790 680.9188,0.3012570 
681.4009,0.3003680 681.8831,0.3009410 682.3652,0.2709080 682.8473,0.2173000 
683.3294,0.1758440 683.8115,0.1593320 684.2936,0.1680330 684.7758,0.2296150 
685.2579,0.3435070 685.7400,0.3864820 686.2221,0.2450270 
686.7042,9.2067003E-02 687.1863,1.1417000E-02 687.6685,1.0985000E-02 
688.1506,6.2976003E-02 688.6327,0.1976170 689.1148,0.3246610 
689.5969,0.3268260 690.0790,0.2182290 690.5612,0.2385220 691.0433,0.4301450 
691.5254,0.6556370 692.0075,0.7706210 692.4896,0.7998890 692.9717,0.7866550 
693.4539,0.7417840 693.9360,0.6592850 694.4181,0.3775170 
694.9002,9.6012004E-02 695.3823,0.1248170 695.8644,1.113802 696.3466,1.686872 
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698.7571,0.7127540 699.2393,0.8071780 699.7214,0.8300290 700.2035,0.7885590 
700.6856,0.6928540 701.1677,0.6221850 701.6498,0.6853960 702.1320,0.7601170 
702.6141,0.6517130 703.0962,0.3861060 703.5783,0.2227580 704.0604,0.3568520 
704.5425,0.5644090 705.0247,0.7387530 705.5068,0.8789210 705.9889,0.9264220 
706.4710,0.8309760 706.9531,0.7071130 707.4352,0.6261990 707.9174,0.5916410 
708.3995,0.5648880 708.8816,0.5420490 709.3637,0.5391320 709.8458,0.5935600 
710.3279,0.6820090 710.8101,0.7404360 711.2922,0.7463520 711.7743,0.7650260 
712.2564,0.8935450 712.7385,1.043405 713.2206,1.105955 713.7028,0.9520760 
714.1849,0.8441310 714.6670,0.8942380 715.1491,0.9948130 715.6312,0.9878190 
716.1133,0.8034200 716.5955,0.7168700 717.0776,0.8084710 717.5597,0.9797960 
718.0418,1.012332 718.5239,0.9204610 719.0060,0.8315250 719.4882,0.7728350 
719.9703,0.7644220 720.4524,0.8831360 720.9345,1.071712 721.4166,1.191371 
721.8987,1.072687 722.3809,0.9604990 722.8630,1.010006 723.3451,1.187881 
723.8272,1.249856 724.3093,1.116829 724.7914,0.9723790 725.2736,0.8708210 
725.7557,0.8211860 726.2378,0.8273390 726.7199,0.8913260 727.2020,0.9563850 
727.6841,1.008771 728.1663,1.036898 728.6484,0.9717020 729.1305,0.8206450 
729.6126,0.7581800 730.0947,1.052207 730.5768,1.383545 731.0590,1.453943 
731.5411,1.153307 732.0232,0.9309110 732.5053,0.9324100 732.9874,0.9908130 
733.4695,0.9917800 733.9517,0.8820710 734.4338,0.9386870 734.9159,1.209070 
735.3980,1.489348 735.8801,1.567480 736.3622,1.476686 736.8444,1.317698 
737.3265,1.083199 737.8086,0.9036530 738.2907,0.9608200 738.7728,1.123653 
739.2549,1.220881 739.7371,1.166109 740.2192,1.115605 740.7013,1.089175 
741.1834,1.096944 741.6655,1.162856 742.1476,1.340519 742.6298,1.445447 
743.1119,1.434536 743.5940,1.380527 744.0761,1.422446 744.5582,1.535783 
745.0403,1.578841 745.5225,1.489787 746.0046,1.363797 746.4867,1.311357 
746.9688,1.326003 747.4509,1.363245 747.9330,1.372636 748.4152,1.404127 
748.8973,1.535601 749.3794,1.727374 749.8615,1.807788 750.3436,1.694441 
750.8257,1.591510 751.3079,1.558332 751.7900,1.575240 752.2721,1.567092 
752.7542,1.538018 753.2363,1.512601 753.7184,1.468793 754.2006,1.430865 
754.6827,1.482398 755.1648,1.607562 755.6469,1.718301 756.1290,1.841811 
756.6111,1.881813 757.0933,1.722485 757.5754,1.380437 758.0575,1.179166 
758.5396,1.189096 759.0217,1.260827 759.5038,1.362781 759.9860,1.486605 
760.4681,1.538913 760.9502,1.513122 761.4323,1.441966 761.9144,1.323390 
762.3965,1.192874 762.8787,1.114495 763.3608,1.087373 763.8429,1.079987 
764.3250,1.097834 764.8071,1.109628 765.2892,1.080886 765.7714,0.9985990 
766.2535,0.9738350 766.7356,1.087545 767.2177,1.161564 767.6998,1.070765 
768.1819,0.7994950 768.6641,0.6368430 769.1462,0.5907440 769.6283,0.5988520 
770.1104,0.6071820 770.5925,0.6341400 771.0746,0.7517780 771.5568,0.9720640 
772.0389,1.110155 772.5210,0.9782070 773.0031,0.7675420 773.4852,0.6205480 
773.9673,0.5623290 774.4495,0.5514170 774.9316,0.6196720 775.4137,0.6940820 
775.8958,0.7158180 776.3779,0.6798550 776.8600,0.6471630 777.3422,0.6183370 
777.8243,0.6035950 778.3064,0.6490600 778.7885,0.7079340 779.2706,0.6590500 
779.7527,0.4563710 780.2349,0.3220280 780.7170,0.4620600 781.1991,0.6882990 
781.6812,0.8402060 782.1633,0.8997610 782.6454,0.8528810 783.1276,0.6305420 
783.6097,0.3847200 784.0918,0.2791850 784.5739,0.3167760 785.0560,0.3333020 
785.5381,0.3119570 786.0203,0.2720340 786.5024,0.2315030 786.9845,0.1872940 
787.4666,0.1252270 787.9487,2.3531999E-02 788.4308,3.0272000E-02 
788.9130,5.5417001E-02 789.3951,0.1847470 789.8772,0.2597100 
790.3593,0.2524190 790.8414,0.2224420 791.3235,0.1479280 
791.8057,8.0583997E-02 792.2878,0.1070250 792.7699,0.2189110 
793.2520,0.2619170 793.7341,0.2068280 794.2162,0.1151370 
794.6984,3.6417000E-02 795.1805,2.9222000E-02 795.6626,8.0410004E-02 
796.1447,0.1091000 796.6268,0.1383080 797.1089,0.1860780 797.5911,0.2339410 
798.0732,0.2602800 798.5553,0.2497640 799.0374,0.2506590 799.5195,0.2605590 
800.0016,0.2901790 800.4838,0.3867100 800.9659,0.5268610 801.4480,0.5669000 
801.9301,0.4646850 802.4122,0.3252370 802.8943,0.1962100 803.3765,0.1142820 
803.8586,0.1374990 804.3407,0.3870360 804.8228,0.5479130 805.3049,0.4669530 
805.7870,0.3192000 806.2692,0.2889830 806.7513,0.4277920 807.2334,0.4721400 
807.7155,0.3822260 808.1976,0.2430110 808.6797,0.1290250 
809.1619,5.5365998E-02 809.6440,9.4765000E-02 810.1261,0.3046130 
810.6082,0.4647970 811.0903,0.3642360 811.5724,0.1485400 
812.0546,2.5835000E-02 812.5367,0.1440180 813.0188,0.1876050 
813.5009,0.1208780 813.9830,1.8559000E-02 814.4651,3.7480000E-02 
814.9473,4.4064999E-02 815.4294,5.4157998E-02 815.9115,7.3062003E-02 
816.3936,9.9440001E-02 816.8757,0.1505780 817.3578,0.2039630 
817.8400,0.2223420 818.3221,0.1983580 818.8042,0.1352240 
819.2863,2.5082000E-02 819.7684,0.1172560 820.2505,0.2829880 
820.7327,0.4998630 821.2148,0.6749610 821.6969,0.8215730 822.1790,0.9020350 
822.6611,0.8312240 823.1432,0.6393380 823.6254,0.5344560 824.1075,0.5469210 
824.5896,0.5758720 825.0717,0.4720190 825.5538,0.3589760 826.0359,0.4083610 
826.5181,0.7295380 827.0002,0.9326060 827.4823,0.8249050 827.9644,0.6561950 
828.4465,0.5957970 828.9286,0.6832050 829.4108,0.6764070 829.8929,0.5456960 
830.3750,0.4379600 830.8571,0.5212460 831.3392,0.7183320 831.8214,0.8944660 
832.3035,1.037378 832.7856,1.084835 833.2677,0.8620800 833.7498,0.6201950 
834.2319,0.5534820 834.7141,0.7257190 835.1962,0.9198020 835.6783,1.168268 
836.1604,1.383369 836.6425,1.483185 837.1246,1.476328 837.6068,1.506741 
838.0889,1.575102 838.5710,1.694162 839.0531,1.865702 839.5352,2.086296 
840.0173,2.347044 840.4995,2.650896 840.9816,3.031300 841.4637,3.686138 
841.9458,4.226011 842.4279,4.447594 842.9100,4.357700 843.3922,4.391958 
843.8743,4.563271 844.3564,4.782721 844.8385,4.961098 845.3206,5.159428 
845.8027,5.545317 846.2849,6.095419 846.7670,6.668043 847.2491,7.227192 
847.7312,7.739088 848.2133,8.152205 848.6954,8.482389 849.1776,8.864651 
849.6597,9.302412 850.1418,9.807058 850.6239,10.40002 851.1060,11.04835 
851.5881,11.63277 852.0703,12.15955 852.5524,12.69667 853.0345,13.28146 
853.5166,13.88056 853.9987,14.52744 854.4808,15.16925 854.9630,15.67305 
855.4451,15.99473 855.9272,16.15629 856.4093,16.08792 856.8914,15.90565 
857.3735,15.91206 857.8557,16.13041 858.3378,16.23728 858.8199,16.15189 
859.3020,15.90942 859.7841,15.49180 860.2662,14.97005 860.7484,14.49292 
861.2305,14.13877 861.7126,13.78531 862.1947,13.37807 862.6768,12.94080 
863.1589,12.51936 863.6411,12.11408 864.1232,11.72675 864.6053,11.35466 
865.0874,10.98166 865.5695,10.55999 866.0516,10.12056 866.5338,9.724443 
867.0159,9.356443 867.4980,9.134394 867.9801,9.312418 868.4622,9.567951 
868.9443,9.583139 869.4265,9.149433 869.9086,8.867603 870.3907,8.763388 
870.8728,8.763269 871.3549,8.830767 871.8370,8.960457 872.3192,9.070034 
872.8013,9.157570 873.2834,9.278139 873.7655,9.542225 874.2476,9.819202 
874.7297,9.908648 875.2119,9.785656 875.6940,9.877777 876.1761,10.59777 
876.6582,11.22018 877.1403,11.35989 877.6224,11.07889 878.1046,11.30531 
878.5867,12.05643 879.0688,12.89624 879.5509,13.53273 880.0330,14.10513 
880.5151,14.85036 880.9973,15.71398 881.4794,16.48383 881.9615,16.86134 
882.4436,17.35741 882.9257,18.23464 883.4078,19.35973 883.8900,20.42398 
884.3721,21.42133 884.8542,22.38103 885.3363,23.28438 885.8184,24.19853 
886.3005,25.24895 886.7827,26.40940 887.2648,27.59719 887.7469,28.76633 
888.2290,29.97487 888.7111,31.16684 889.1932,32.44703 889.6754,33.98721 
890.1575,35.89893 890.6396,37.72246 891.1217,39.37539 891.6038,41.01115 
892.0859,42.87555 892.5681,44.89407 893.0502,46.80891 893.5323,48.53450 
894.0144,50.36926 894.4965,52.51211 894.9786,54.82797 895.4608,57.18506 
895.9429,59.44757 896.4250,62.21950 896.9071,65.62765 897.3892,69.24535 
897.8713,72.56539 898.3535,75.77788 898.8356,79.88680 899.3177,84.86862 
899.7998,90.25897 900.2819,95.96384 900.7640,101.8247 901.2462,107.7100 
901.7283,113.6133 902.2104,120.0367 902.6925,126.8034 903.1746,134.2482 
903.6567,142.7059 904.1389,151.8179 904.6210,160.6765 905.1031,169.3028 
905.5852,178.1892 906.0673,187.6230 906.5494,197.2807 907.0316,207.1329 
907.5137,216.9075 907.9958,226.2639 908.4779,235.6448 908.9600,243.6722 
909.4421,250.1441 909.9243,255.3187 910.4064,259.8346 910.8885,263.6208 
911.3706,265.9763 911.8527,266.8970 912.3348,265.7437 912.8170,261.2701 
913.2991,254.7206 913.7812,247.5073 914.2633,239.9950 914.7454,231.2115 
915.2275,220.5480 915.7097,209.1756 916.1918,197.6296 916.6739,185.9138 
917.1560,174.0963 917.6381,162.2636 918.1202,150.9978 918.6024,140.7864 
919.0845,131.3352 919.5666,122.3317 920.0487,113.8458 920.5308,105.8837 
921.0129,98.46299 921.4951,91.60166 921.9772,85.28109 922.4593,79.46622 
922.9414,74.01771 923.4235,68.98083 923.9056,64.47872 924.3878,60.68320 
924.8699,57.16165 925.3520,53.21110 925.8341,49.23086 926.3162,45.78761 
926.7983,43.36488 927.2805,40.98891 927.7626,38.46117 928.2447,35.95977 
928.7268,33.71215 929.2089,31.73536 929.6910,29.71619 930.1732,27.62721 
930.6553,25.68709 931.1374,24.23300 931.6195,23.00962 932.1016,21.65826 
932.5837,20.13160 933.0659,18.74316 933.5480,17.70548 934.0301,16.68504 
934.5122,15.54836 934.9943,14.32265 935.4764,13.24706 935.9586,12.30099 
936.4407,11.44569 936.9228,10.67427 937.4049,9.960602 937.8870,9.254322 
938.3691,8.566977 938.8513,7.962881 939.3334,7.448261 939.8155,7.058220 
940.2976,6.890043 940.7797,6.754881 941.2618,6.300463 941.7440,5.559788 
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1002.009,1.191925 1002.491,1.215694 1002.973,1.568506 1003.455,1.791228 
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1021.293,10.38060 1021.775,10.96792 1022.257,11.57006 1022.740,12.10214 
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1103.735,8.3007999E-02 1104.217,0.1382890 1104.699,0.2955870 
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1124.466,9.3341000E-02 1124.948,4.4649001E-02 1125.430,0.1430150 
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1248.852,0.5610300 1249.334,0.4138040 1249.817,0.3932180 1250.299,0.4218590 
1250.781,0.5251990 1251.263,0.5912290 1251.745,0.5475490 1252.227,0.4653680 
1252.709,0.5490760 1253.191,0.7390620 1253.673,0.8736260 1254.156,0.9233000 
1254.638,0.8853030 1255.120,0.6388590 1255.602,0.4973290 1256.084,0.6135110 
1256.566,0.8250930 1257.048,0.7681160 1257.530,0.5737760 1258.012,0.4936050 
1258.495,0.5814500 1258.977,0.6609450 1259.459,0.7015980 1259.941,0.7247320 
1260.423,0.7310480 1260.905,0.7691100 1261.387,0.8430110 1261.869,0.9099810 
1262.352,0.9200050 1262.834,0.8601260 1263.316,0.7581760 1263.798,0.5761390 
1264.280,0.5074930 1264.762,0.6271500 1265.244,0.8227590 1265.726,1.033377 
1266.208,1.187966 1266.691,1.164781 1267.173,0.9991220 1267.655,0.9111150 
1268.137,0.9100670 1268.619,0.9094340 1269.101,0.8899540 1269.583,0.8491430 
1270.065,0.7308560 1270.548,0.6330650 1271.030,0.6972800 1271.512,0.8659320 
1271.994,0.8630520 1272.476,0.6929560 1272.958,0.5586600 1273.440,0.5052290 
1273.922,0.4932430 1274.405,0.5374570 1274.887,0.5698080 1275.369,0.5404930 
1275.851,0.4758680 1276.333,0.4385210 1276.815,0.4307970 1277.297,0.4839940 
1277.779,0.6098790 1278.261,0.6925210 1278.744,0.6085520 1279.226,0.5508940 
1279.708,0.6154330 1280.190,0.7126620 1280.672,0.6215660 1281.154,0.4341730 
1281.636,0.4164250 1282.118,0.6034940 1282.600,0.7298360 1283.083,0.6940980 
1283.565,0.6269540 1284.047,0.5508030 1284.529,0.4700360 1285.011,0.3629050 
1285.493,0.2692970 1285.975,0.2887330 1286.457,0.4148200 1286.939,0.4160690 
1287.422,0.2202200 1287.904,0.1124250 1288.386,0.1657380 1288.868,0.2312690 
1289.350,4.9001001E-02 1289.832,0.1241510 1290.314,4.2738002E-02 
1290.796,0.4742480 1291.279,0.7215900 1291.761,0.7723460 1292.243,0.7542660 
1292.725,0.6819940 1293.207,0.5864540 1293.689,0.4377640 1294.171,0.3287710 
1294.653,0.3584450 1295.135,0.4546040 1295.618,0.5087890 1296.100,0.4587980 
1296.582,0.4256370 1297.064,0.3545840 1297.546,0.2941120 1298.028,0.3032650 
1298.510,0.2717480 1298.992,0.1158980 1299.475,1.1034000E-02 
1299.957,0.1595860 1300.439,0.4866100 1300.921,0.4655200 1301.403,0.1772590 
1301.885,0.0000000E+00 
##MOLFORM=Al2 Fe3 O12 Si3
##RESOLUTION=4
##PRESSURE=100
##TEMPERATURE=26.85
##END=
