##TITLE=1000463
##JCAMP-DX=4.24
##DATA TYPE=RAMAN SPECTRUM
##SOURCE REFERENCE=http://solsa.crystallography.net/rod/1000463.rod
##OWNER=PUBLIC DOMAIN
##XUNITS=1/CM
##YUNITS=ARBITRARY UNITS
##FIRSTX=183.3885
##LASTX=1292.739
##XFACTOR=1
##YFACTOR=1
##NPOINTS=2302
##FIRSTY=0.0000000E+00
##LASTY=0.0000000E+00
##XYPOINTS=(XY..XY)
183.3885,0.0000000E+00 183.8706,5.5187002E-02 184.3528,2.6489001E-02 
184.8349,6.3609998E-03 185.3170,6.0470998E-02 185.7991,0.1715320 
186.2812,0.3998950 186.7633,0.6375430 187.2455,0.6929230 187.7276,0.4928970 
188.2097,0.1839120 188.6918,2.8664000E-02 189.1739,7.9190005E-03 
189.6560,6.1588001E-02 190.1382,0.1810400 190.6203,0.3454990 
191.1024,0.4588680 191.5845,0.5066410 192.0666,0.4952980 192.5487,0.4209120 
193.0309,0.2724040 193.5130,0.1659430 193.9951,0.2457010 194.4772,0.4998040 
194.9593,0.6737960 195.4414,0.7029720 195.9236,0.6423320 196.4057,0.6300530 
196.8878,0.5775550 197.3699,0.5538670 197.8520,0.6576480 198.3341,0.8968030 
198.8163,1.058445 199.2984,1.031549 199.7805,0.8039530 200.2626,0.7215630 
200.7447,0.8074740 201.2268,0.9864690 201.7090,1.129099 202.1911,1.013088 
202.6732,1.021032 203.1553,1.284351 203.6374,1.736807 204.1195,1.858324 
204.6017,1.567602 205.0838,1.164431 205.5659,0.9582730 206.0480,0.9895610 
206.5301,0.9871790 207.0122,0.8824480 207.4944,0.6847320 207.9765,0.4768810 
208.4586,0.2252940 208.9407,3.1438999E-02 209.4228,1.2875000E-02 
209.9049,0.1999570 210.3871,0.4533710 210.8692,0.7978210 211.3513,1.219500 
211.8334,1.386257 212.3155,1.238115 212.7976,0.9345210 213.2798,0.6135410 
213.7619,0.2304100 214.2440,3.2860000E-02 214.7261,0.1079790 
215.2082,7.5380001E-03 215.6903,9.3060002E-02 216.1725,0.1326260 
216.6546,0.1632860 217.1367,0.2499730 217.6188,0.4620590 218.1009,0.5409010 
218.5830,0.3572860 219.0651,0.1168230 219.5473,0.3137590 220.0294,0.1266710 
220.5115,0.2012460 220.9936,0.3769400 221.4757,0.3155020 221.9578,0.3026710 
222.4400,0.4196320 222.9221,0.6807140 223.4042,0.9202800 223.8863,1.173290 
224.3684,1.372564 224.8505,1.413633 225.3327,1.171406 225.8148,1.043926 
226.2969,1.193104 226.7790,1.669161 227.2611,1.840996 227.7432,1.536186 
228.2254,1.105503 228.7075,0.9644950 229.1896,1.261393 229.6717,1.553637 
230.1538,1.750101 230.6359,1.844049 231.1181,1.889259 231.6002,1.837486 
232.0823,1.782669 232.5644,1.855507 233.0465,2.199511 233.5286,2.391071 
234.0108,2.248791 234.4929,1.714443 234.9750,1.539911 235.4571,1.907471 
235.9392,2.459568 236.4213,2.824007 236.9035,2.942314 237.3856,2.972471 
237.8677,2.908222 238.3498,2.732323 238.8319,2.675798 239.3140,2.809807 
239.7962,3.016758 240.2783,3.125269 240.7604,3.036966 241.2425,3.062920 
241.7246,3.308250 242.2067,3.796177 242.6889,4.118816 243.1710,4.179371 
243.6531,4.138094 244.1352,4.166267 244.6173,4.299879 245.0994,4.457943 
245.5816,4.659897 246.0637,4.911287 246.5458,4.997320 247.0279,4.753624 
247.5100,4.484837 247.9921,4.493099 248.4743,4.939581 248.9564,5.345142 
249.4385,5.612011 249.9206,5.739567 250.4027,5.888693 250.8848,6.085014 
251.3670,6.280102 251.8491,6.424314 252.3312,6.501387 252.8133,6.561043 
253.2954,6.603777 253.7775,6.633177 254.2597,6.683701 254.7418,6.741255 
255.2239,6.826378 255.7060,6.947157 256.1881,7.099401 256.6702,7.325056 
257.1523,7.687517 257.6345,8.152576 258.1166,8.420872 258.5987,8.454475 
259.0808,8.346146 259.5629,8.126169 260.0450,7.723869 260.5272,7.416265 
261.0093,7.259331 261.4914,7.228403 261.9735,7.206276 262.4556,7.230682 
262.9377,7.198351 263.4199,7.030144 263.9020,6.690626 264.3841,6.320789 
264.8662,5.887114 265.3483,5.440128 265.8304,5.176054 266.3126,5.156710 
266.7947,5.187696 267.2768,5.177849 267.7589,5.149839 268.2410,4.994946 
268.7231,4.634638 269.2053,4.174179 269.6874,3.954065 270.1695,4.066198 
270.6516,4.169146 271.1337,4.037781 271.6158,3.593245 272.0980,3.308992 
272.5801,3.254257 273.0622,3.339323 273.5443,3.321430 274.0264,3.173853 
274.5085,3.011856 274.9907,2.898664 275.4728,2.842794 275.9549,2.753353 
276.4370,2.605400 276.9191,2.439583 277.4012,2.367552 277.8834,2.432074 
278.3655,2.513622 278.8476,2.580854 279.3297,2.636877 279.8118,2.520348 
280.2939,2.180691 280.7761,1.780514 281.2582,1.579332 281.7403,1.593697 
282.2224,1.619852 282.7045,1.564819 283.1866,1.440256 283.6688,1.401104 
284.1509,1.467842 284.6330,1.554127 285.1151,1.563421 285.5972,1.495461 
286.0793,1.371046 286.5615,1.168825 287.0436,0.9128760 287.5257,0.7136800 
288.0078,0.5717950 288.4899,0.4811340 288.9720,0.4641820 289.4542,0.5111680 
289.9363,0.5145850 290.4184,0.4183460 290.9005,0.2678390 291.3826,0.1893220 
291.8647,0.1852130 292.3469,0.2161310 292.8290,0.2749080 293.3111,0.3475480 
293.7932,0.3696400 294.2753,0.3145470 294.7574,0.2118780 
295.2396,9.6077003E-02 295.7217,3.0447001E-02 296.2038,0.1115320 
296.6859,5.3576998E-02 297.1680,8.7063000E-02 297.6501,0.1529180 
298.1323,0.1024840 298.6144,1.1028000E-02 299.0965,0.1595480 
299.5786,0.3279400 300.0607,0.4136390 300.5428,0.3019100 
301.0250,7.3798999E-02 301.5071,0.1431850 301.9892,0.3530010 
302.4713,0.4832250 302.9534,0.3645820 303.4355,7.7000000E-02 
303.9177,0.1187290 304.3998,5.9436999E-02 304.8819,0.3646700 
305.3640,0.4376620 305.8461,0.2135450 306.3282,3.3936001E-02 
306.8104,2.8755000E-02 307.2925,0.1326290 307.7746,0.2491740 
308.2567,0.1447910 308.7388,1.4710000E-03 309.2209,2.6279001E-02 
309.7031,0.2381690 310.1852,0.4044400 310.6673,0.3095910 
311.1494,8.1561998E-02 311.6315,9.6856996E-02 312.1136,0.1744330 
312.5958,0.1658120 313.0779,2.3810999E-02 313.5600,0.2350520 
314.0421,0.4244650 314.5242,0.3929920 315.0063,0.2591110 315.4885,0.1392690 
315.9706,4.3412998E-02 316.4527,7.0739998E-03 316.9348,6.7250002E-03 
317.4169,7.7079996E-02 317.8990,0.1698230 318.3812,0.3233320 
318.8633,0.4635720 319.3454,0.5312250 319.8275,0.4539790 320.3096,0.3979000 
320.7917,0.4260600 321.2739,0.5145650 321.7560,0.6027030 322.2381,0.7221030 
322.7202,0.8013190 323.2023,0.7784290 323.6844,0.5471190 324.1666,0.4564210 
324.6487,0.7151490 325.1308,1.123766 325.6129,1.369831 326.0950,1.215014 
326.5771,1.074396 327.0593,1.099415 327.5414,1.362278 328.0235,1.510695 
328.5056,1.383774 328.9877,1.191833 329.4698,1.156519 329.9520,1.510853 
330.4341,1.746532 330.9162,1.723103 331.3983,1.428307 331.8804,1.270679 
332.3625,1.350513 332.8447,1.482538 333.3268,1.516415 333.8089,1.308367 
334.2910,1.273024 334.7731,1.541584 335.2552,2.036180 335.7374,2.319984 
336.2195,2.315882 336.7016,2.229179 337.1837,2.169855 337.6658,2.146704 
338.1479,2.121492 338.6301,2.090328 339.1122,2.057198 339.5943,2.013737 
340.0764,1.933121 340.5585,1.931824 341.0406,2.101475 341.5227,2.462395 
342.0049,2.714655 342.4870,2.851851 342.9691,2.898829 343.4512,2.867973 
343.9333,2.753897 344.4154,2.640978 344.8976,2.531828 345.3797,2.445108 
345.8618,2.509398 346.3439,2.744631 346.8260,3.003702 347.3081,3.140261 
347.7903,3.168043 348.2724,3.183069 348.7545,3.199694 349.2366,3.225677 
349.7187,3.273052 350.2008,3.343130 350.6830,3.441456 351.1651,3.649057 
351.6472,3.885103 352.1293,3.899534 352.6114,3.556910 353.0935,3.228970 
353.5757,3.472281 354.0578,4.128544 354.5399,4.659445 355.0220,4.668980 
355.5041,4.424889 355.9862,4.216347 356.4684,4.057457 356.9505,3.976889 
357.4326,4.071487 357.9147,4.254036 358.3968,4.409981 358.8789,4.359732 
359.3611,4.297047 359.8432,4.454344 360.3253,4.827913 360.8074,5.104805 
361.2895,4.971083 361.7716,4.686241 362.2538,4.522284 362.7359,4.562975 
363.2180,4.691845 363.7001,5.007137 364.1822,5.428261 364.6643,5.649303 
365.1465,5.299547 365.6286,4.914539 366.1107,4.803705 366.5928,5.187780 
367.0749,5.502783 367.5570,5.621288 368.0392,5.624964 368.5213,5.651754 
369.0034,5.730820 369.4855,5.811863 369.9676,5.946119 370.4497,6.208445 
370.9319,6.156021 371.4140,5.433998 371.8961,4.611431 372.3782,4.262701 
372.8603,4.636724 373.3424,5.065153 373.8246,5.547575 374.3067,6.036335 
374.7888,6.117912 375.2709,5.564631 375.7530,4.983389 376.2351,4.795609 
376.7173,5.121408 377.1994,5.356701 377.6815,5.475698 378.1636,5.474331 
378.6457,5.276155 379.1278,4.823341 379.6100,4.486509 380.0921,4.499132 
380.5742,4.843929 381.0563,5.059122 381.5384,5.129688 382.0205,5.126020 
382.5027,5.192677 382.9848,5.302429 383.4669,5.171993 383.9490,4.507172 
384.4311,3.646091 384.9132,3.484137 385.3954,3.997095 385.8775,4.537622 
386.3596,4.527431 386.8417,4.162001 387.3238,3.852499 387.8059,3.703773 
388.2881,3.601179 388.7702,3.336403 389.2523,2.995441 389.7344,2.841833 
390.2165,3.248875 390.6986,3.784794 391.1808,4.021452 391.6629,3.898891 
392.1450,3.645403 392.6271,3.262169 393.1092,2.876875 393.5913,2.660955 
394.0735,2.899979 394.5556,3.117579 395.0377,3.033829 395.5198,2.678741 
396.0019,2.412415 396.4840,2.466089 396.9662,2.584351 397.4483,2.592293 
397.9304,2.349009 398.4125,2.117039 398.8946,1.895548 399.3767,1.715214 
399.8589,1.651934 400.3410,1.894369 400.8231,2.080902 401.3052,2.080500 
401.7873,1.821646 402.2694,1.649900 402.7516,1.605150 403.2337,1.619560 
403.7158,1.627573 404.1979,1.670330 404.6800,1.611670 405.1621,1.371494 
405.6443,0.9923210 406.1264,0.8134560 406.6085,0.8917750 407.0906,1.017597 
407.5727,1.063993 408.0548,1.031042 408.5370,0.8945690 409.0191,0.6110990 
409.5012,0.2999710 409.9833,0.2186200 410.4654,0.3644790 410.9475,0.4848190 
411.4297,0.4285260 411.9118,0.2492520 412.3939,0.1150910 
412.8760,2.5852000E-02 413.3581,8.2529997E-03 413.8402,0.2102720 
414.3224,0.5087360 414.8045,0.5718730 415.2866,0.1403350 415.7687,0.3682730 
416.2508,0.3761410 416.7329,3.2750000E-03 417.2151,0.2662320 
417.6972,5.3640001E-02 418.1793,0.5456500 418.6614,0.8152310 
419.1435,0.7752190 419.6256,0.6185280 420.1078,0.3253780 
420.5899,1.2890000E-02 421.0720,0.1571750 421.5541,3.6621001E-02 
422.0362,0.2351590 422.5183,0.2785130 423.0005,0.1641540 
423.4826,7.1028002E-02 423.9647,6.2780000E-02 424.4468,7.5692996E-02 
424.9289,6.8963997E-02 425.4110,9.3473002E-02 425.8932,2.8628999E-02 
426.3753,0.2229900 426.8574,0.5585440 427.3395,0.7260670 427.8216,0.5554030 
428.3037,0.4448130 428.7859,0.5658470 429.2680,0.9772930 429.7501,1.192970 
430.2322,1.134336 430.7143,0.9917470 431.1964,0.9632020 431.6786,1.059381 
432.1607,1.227545 432.6428,1.502790 433.1249,1.818449 433.6070,1.948236 
434.0891,1.883032 434.5713,1.742872 435.0534,1.554813 435.5355,1.345314 
436.0176,1.236591 436.4997,1.242682 436.9818,1.336184 437.4640,1.584244 
437.9461,1.911369 438.4282,2.072479 438.9103,1.811483 439.3924,1.431250 
439.8745,1.324585 440.3566,1.466097 440.8387,1.640091 441.3209,1.756174 
441.8030,1.808270 442.2851,1.767359 442.7672,1.559689 443.2493,1.412584 
443.7314,1.553988 444.2136,1.827671 444.6957,1.947111 445.1778,1.651924 
445.6599,1.339388 446.1420,1.165888 446.6241,1.149393 447.1063,1.163355 
447.5884,1.217834 448.0705,1.278769 448.5526,1.322733 449.0347,1.417013 
449.5168,1.395449 449.9990,1.193892 450.4811,0.8770430 450.9632,0.6245000 
451.4453,0.4191970 451.9274,0.3107990 452.4095,0.3790020 452.8917,0.6557920 
453.3738,0.6445960 453.8559,0.2501070 454.3380,0.2056160 454.8201,0.3522450 
455.3022,0.1860390 455.7844,1.6712001E-02 456.2665,0.2301960 
456.7486,0.4048120 457.2307,0.3953780 457.7128,0.2149720 
458.1949,3.4676000E-02 458.6771,2.1576000E-02 459.1592,3.9829998E-03 
459.6413,2.2917001E-02 460.1234,9.3728997E-02 460.6055,0.1378480 
461.0876,7.5658999E-02 461.5698,5.9319001E-02 462.0519,0.2110120 
462.5340,0.4020520 463.0161,0.5643440 463.4982,0.6483420 463.9803,0.6640680 
464.4625,0.6574650 464.9446,0.5499760 465.4267,0.4972950 465.9088,0.6219200 
466.3909,1.034195 466.8730,1.360395 467.3552,1.485153 467.8373,1.498802 
468.3194,1.514774 468.8015,1.530067 469.2836,1.560574 469.7657,1.626389 
470.2479,1.718910 470.7300,1.732876 471.2121,1.578503 471.6942,1.493929 
472.1763,1.655081 472.6584,2.143362 473.1406,2.432217 473.6227,2.430378 
474.1048,2.318853 474.5869,2.361868 475.0690,2.545444 475.5511,2.713619 
476.0333,2.804842 476.5154,2.837456 476.9975,2.852041 477.4796,2.854673 
477.9617,2.838707 478.4438,2.730244 478.9260,2.597530 479.4081,2.595667 
479.8902,2.762413 480.3723,2.975090 480.8544,3.080851 481.3365,3.168808 
481.8187,3.390970 482.3008,4.032085 482.7829,4.631712 483.2650,4.852257 
483.7471,4.753515 484.2292,4.772821 484.7114,5.255135 485.1935,5.754938 
485.6756,5.973112 486.1577,5.634518 486.6398,5.514721 487.1219,5.818480 
487.6041,6.327564 488.0862,6.748484 488.5683,6.975243 489.0504,7.307543 
489.5325,7.858484 490.0146,8.584969 490.4968,9.082426 490.9789,9.231117 
491.4610,9.451530 491.9431,10.08681 492.4252,11.13653 492.9073,11.99236 
493.3895,12.59772 493.8716,13.08893 494.3537,13.59646 494.8358,14.13544 
495.3179,14.83328 495.8000,15.81376 496.2822,16.90193 496.7643,17.76698 
497.2464,18.46483 497.7285,19.26699 498.2106,20.38614 498.6927,21.68588 
499.1749,23.08446 499.6570,24.59314 500.1391,26.03284 500.6212,27.22922 
501.1033,28.32324 501.5854,29.49624 502.0676,30.78306 502.5497,32.15204 
503.0318,33.71796 503.5139,35.41491 503.9960,36.86398 504.4781,37.73711 
504.9603,38.69334 505.4424,40.00022 505.9245,41.77439 506.4066,43.47825 
506.8887,45.12318 507.3708,46.67985 507.8530,48.11127 508.3351,49.36655 
508.8172,50.69422 509.2993,52.18057 509.7814,53.72008 510.2635,55.07898 
510.7457,56.26429 511.2278,57.27267 511.7099,58.06855 512.1920,58.68191 
512.6741,59.21372 513.1563,59.68912 513.6384,60.10435 514.1205,60.54493 
514.6026,60.86617 515.0847,60.85626 515.5668,60.37133 516.0490,59.70694 
516.5311,59.03058 517.0132,58.31400 517.4953,57.48701 517.9774,56.45359 
518.4595,55.35273 518.9417,54.18230 519.4238,52.94754 519.9059,51.89418 
520.3880,51.23964 520.8701,50.57132 521.3522,49.66435 521.8344,48.38325 
522.3165,47.13959 522.7986,45.92445 523.2807,44.73936 523.7628,43.62850 
524.2449,42.58763 524.7271,41.60754 525.2092,40.73534 525.6913,39.90319 
526.1734,38.74068 526.6555,37.24141 527.1376,35.79224 527.6198,34.69090 
528.1019,33.84832 528.5840,33.04791 529.0661,32.28398 529.5482,31.53943 
530.0303,30.81569 530.5125,30.08067 530.9946,29.24397 531.4767,28.24569 
531.9588,27.19957 532.4409,26.10331 532.9230,25.00634 533.4052,24.01718 
533.8873,23.23738 534.3694,22.52406 534.8515,21.82219 535.3336,21.10789 
535.8157,20.49000 536.2979,20.15835 536.7800,19.74809 537.2621,18.93974 
537.7442,17.44336 538.2263,16.33057 538.7084,15.77904 539.1906,15.52072 
539.6727,15.01861 540.1548,14.24300 540.6369,13.51700 541.1190,12.98373 
541.6011,12.57127 542.0833,12.06820 542.5654,11.47929 543.0475,10.91064 
543.5296,10.43276 544.0117,10.02702 544.4938,9.694073 544.9760,9.448263 
545.4581,9.154110 545.9402,8.663326 546.4223,8.078499 546.9044,7.530987 
547.3865,7.073055 547.8687,6.648703 548.3508,6.213013 548.8329,5.792227 
549.3150,5.470802 549.7971,5.382420 550.2792,5.276056 550.7614,5.060570 
551.2435,4.726395 551.7256,4.443319 552.2077,4.236000 552.6898,4.047300 
553.1719,3.815668 553.6541,3.524620 554.1362,3.358879 554.6183,3.390991 
555.1004,3.429611 555.5825,3.085264 556.0646,2.423445 556.5468,1.895870 
557.0289,1.719984 557.5110,1.724436 557.9931,1.691381 558.4752,1.617989 
558.9573,1.494932 559.4395,1.181593 559.9216,0.9010830 560.4037,0.9161510 
560.8858,1.302361 561.3679,1.545061 561.8500,1.299488 562.3322,0.8898160 
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573.9030,7.2645001E-02 574.3851,0.1377330 574.8672,0.2315670 
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617.2934,4.350227 617.7755,4.402330 618.2576,4.470881 618.7397,4.563360 
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623.0788,4.155197 623.5609,3.945442 624.0430,3.763092 624.5251,3.648428 
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710.8240,0.6805690 711.3062,0.9202230 711.7883,1.007637 712.2704,0.9040220 
712.7525,0.7944950 713.2346,0.7714500 713.7167,0.8198170 714.1989,0.9328730 
714.6810,1.205095 715.1631,1.388130 715.6452,1.364862 716.1273,1.249987 
716.6094,1.150885 717.0916,1.056334 717.5737,1.038568 718.0558,1.108856 
718.5379,1.243315 719.0200,1.420710 719.5021,1.629009 719.9843,1.820402 
720.4664,1.999020 720.9485,2.166885 721.4306,2.308039 721.9127,2.396366 
722.3948,2.392145 722.8770,2.154364 723.3591,1.946264 723.8412,1.882051 
724.3233,1.937189 724.8054,2.011305 725.2875,2.075375 725.7697,2.172981 
726.2518,2.331631 726.7339,2.534992 727.2160,2.647184 727.6981,2.659756 
728.1802,2.681250 728.6624,2.785347 729.1445,2.929129 729.6266,3.045225 
730.1087,3.131317 730.5908,3.168932 731.0729,3.069773 731.5551,2.953802 
732.0372,2.948874 732.5193,3.070856 733.0014,3.071651 733.4835,2.701654 
733.9656,2.401901 734.4478,2.431801 734.9299,2.861702 735.4120,3.075047 
735.8941,3.034758 736.3762,2.896151 736.8583,2.788157 737.3405,2.689369 
737.8226,2.521360 738.3047,2.264215 738.7868,2.042742 739.2689,2.024174 
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760.9642,2.586622 761.4463,3.014254 761.9284,3.531876 762.4105,4.016699 
762.8926,4.383892 763.3748,4.691446 763.8569,5.014742 764.3390,5.365185 
764.8211,5.776421 765.3032,6.343138 765.7853,6.911230 766.2675,7.372053 
766.7496,7.722176 767.2317,8.170498 767.7138,8.798996 768.1959,9.419220 
768.6780,9.908352 769.1602,10.28954 769.6423,10.86468 770.1244,11.64190 
770.6065,12.50375 771.0886,13.50349 771.5707,14.48380 772.0529,15.10784 
772.5350,15.38705 773.0171,15.64546 773.4992,16.07259 773.9813,16.53943 
774.4634,17.00424 774.9456,17.48480 775.4277,17.73933 775.9098,17.63367 
776.3919,17.48084 776.8740,17.48883 777.3561,17.66327 777.8383,17.58597 
778.3204,17.23636 778.8025,16.86390 779.2846,16.77792 779.7667,16.77068 
780.2488,16.49320 780.7310,15.91268 781.2131,15.15125 781.6952,13.95076 
782.1773,12.82402 782.6594,12.19670 783.1415,12.32542 783.6237,12.17916 
784.1058,11.62366 784.5879,10.98470 785.0699,10.50239 785.5521,10.17352 
786.0342,9.820459 786.5163,9.435690 786.9984,9.042273 787.4805,8.594803 
787.9626,8.176477 788.4448,7.907063 788.9269,7.810963 789.4090,7.780107 
789.8911,7.921885 790.3732,7.999578 790.8553,7.788403 791.3375,7.115032 
791.8196,6.667728 792.3017,6.515570 792.7838,6.452862 793.2659,6.294842 
793.7480,6.055317 794.2302,5.873758 794.7123,5.756979 795.1944,5.733114 
795.6765,5.927639 796.1586,6.180538 796.6407,6.292858 797.1229,6.219658 
797.6050,6.064396 798.0871,5.639038 798.5692,5.308004 799.0513,5.405386 
799.5334,6.209799 800.0156,6.507973 800.4977,6.137419 800.9798,5.649277 
801.4619,5.604921 801.9440,5.917459 802.4261,6.173803 802.9083,6.328741 
803.3904,6.499704 803.8725,6.843199 804.3546,7.223019 804.8367,7.487331 
805.3188,7.579151 805.8010,7.675808 806.2831,7.808990 806.7652,7.964798 
807.2473,8.130018 807.7294,8.300663 808.2115,8.490082 808.6937,8.685345 
809.1758,8.953493 809.6579,9.511730 810.1400,10.17453 810.6221,10.39427 
811.1042,10.08321 811.5864,9.787205 812.0685,9.953701 812.5506,10.24726 
813.0327,10.36233 813.5148,10.16478 813.9969,10.11479 814.4791,10.28644 
814.9612,10.54146 815.4433,10.84444 815.9254,11.20107 816.4075,11.22883 
816.8896,10.88628 817.3718,10.50986 817.8539,10.43842 818.3360,10.51935 
818.8181,10.51521 819.3002,10.39302 819.7823,10.28523 820.2645,10.21104 
820.7466,10.20573 821.2287,10.33236 821.7108,10.63850 822.1929,10.78579 
822.6750,10.73328 823.1572,10.63597 823.6393,10.58936 824.1214,10.57610 
824.6035,10.60213 825.0856,10.67418 825.5677,10.71620 826.0499,10.63731 
826.5320,10.52111 827.0141,10.42642 827.4962,10.35800 827.9783,10.36516 
828.4604,10.66674 828.9426,10.84567 829.4247,10.66616 829.9068,10.11178 
830.3889,9.688673 830.8710,9.418055 831.3531,9.172876 831.8353,8.877447 
832.3174,8.536118 832.7995,8.152313 833.2816,7.733629 833.7637,7.343742 
834.2458,7.051626 834.7280,6.788212 835.2101,6.507843 835.6922,6.206614 
836.1743,5.916073 836.6564,5.654045 837.1385,5.343447 837.6207,4.905287 
838.1028,4.414488 838.5849,4.261992 839.0670,4.398504 839.5491,4.407358 
840.0313,3.911625 840.5134,3.307266 840.9955,2.974905 841.4776,2.877798 
841.9597,2.773167 842.4418,2.547510 842.9240,2.352606 843.4061,2.246817 
843.8882,2.215672 844.3703,2.178122 844.8524,2.118227 845.3345,2.007870 
845.8167,1.813313 846.2988,1.612337 846.7809,1.588945 847.2630,1.665503 
847.7451,1.652504 848.2272,1.350264 848.7094,1.075642 849.1915,1.009535 
849.6736,1.074617 850.1557,1.052444 850.6378,0.8925970 851.1199,0.7497220 
851.6021,0.6557660 852.0842,0.5904960 852.5663,0.4996340 853.0484,0.3967230 
853.5305,0.3494190 854.0126,0.3913120 854.4948,0.4761490 854.9769,0.6520180 
855.4590,0.8083440 855.9411,0.7810780 856.4232,0.2766780 
856.9053,6.7985997E-02 857.3875,0.1964530 857.8696,0.1795750 
858.3517,3.7262000E-02 858.8338,0.2445530 859.3159,0.4016910 
859.7980,0.3835720 860.2802,0.2965950 860.7623,0.2502880 861.2444,0.2156310 
861.7265,0.1286370 862.2086,6.2415998E-02 862.6907,0.1816790 
863.1729,0.1536350 863.6550,2.8158000E-02 864.1371,0.1758000 
864.6192,0.5479810 865.1013,0.6508240 865.5834,0.4281020 866.0656,0.1321370 
866.5477,3.3470001E-02 867.0298,8.6718000E-02 867.5119,5.5969000E-02 
867.9940,4.6813998E-02 868.4761,9.4605997E-02 868.9583,9.2790999E-02 
869.4404,0.2920590 869.9225,0.3219110 870.4046,0.1404860 
870.8867,3.8109001E-02 871.3688,3.9358001E-02 871.8510,6.9091998E-02 
872.3331,0.1001640 872.8152,0.1268520 873.2973,0.1211360 
873.7794,8.2909003E-02 874.2615,1.5505000E-02 874.7437,0.1172180 
875.2258,0.2471810 875.7079,0.3291850 876.1900,0.3606090 876.6721,0.3411900 
877.1542,0.2395310 877.6364,0.1323620 878.1185,9.2789996E-03 
878.6006,0.1155620 879.0827,0.1608300 879.5648,0.1263870 880.0469,0.1166480 
880.5291,0.2156930 881.0112,0.2938250 881.4933,0.1141530 881.9754,0.2023560 
882.4575,0.4070300 882.9396,0.3164980 883.4218,0.2163640 883.9039,0.1773280 
884.3860,0.1636140 884.8681,0.1178150 885.3502,3.4745999E-02 
885.8323,4.3133002E-02 886.3145,0.1187920 886.7966,0.1576680 
887.2787,8.1866004E-02 887.7608,4.9603000E-02 888.2429,0.1124530 
888.7250,4.1638002E-02 889.2072,4.2087000E-02 889.6893,0.3789110 
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892.0999,0.2154650 892.5820,0.2288880 893.0641,0.2003320 893.5462,0.1359700 
894.0283,1.4171000E-02 894.5104,0.1556250 894.9926,0.2361330 
895.4747,2.5147000E-02 895.9568,0.2588970 896.4389,0.1835760 
896.9210,0.2122940 897.4031,0.4859500 897.8853,0.6251420 898.3674,0.6781320 
898.8495,0.6475240 899.3316,0.5479790 899.8137,0.3983220 900.2958,0.2121520 
900.7780,4.6137001E-02 901.2601,0.1374520 901.7422,0.2225310 
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903.6707,0.1273390 904.1528,5.4338999E-02 904.6349,3.3608999E-02 
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1233.438,0.6192420 1233.921,0.5807040 1234.403,0.5077780 1234.885,0.4583560 
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1237.295,0.7366010 1237.777,0.8025000 1238.260,0.7625600 1238.742,0.3354650 
1239.224,1.3497000E-02 1239.706,7.5790003E-02 1240.188,0.3769910 
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1249.830,0.6893730 1250.313,0.6896060 1250.795,0.6391570 1251.277,0.6209050 
1251.759,0.7503070 1252.241,0.8017830 1252.723,0.7105040 1253.205,0.5491520 
1253.687,0.3899210 1254.169,0.2479490 1254.651,0.1277470 
1255.134,4.0716000E-02 1255.616,9.0328999E-02 1256.098,0.5077670 
1256.580,0.7303540 1257.062,0.6236480 1257.544,0.3903470 1258.026,0.2381200 
1258.508,0.1649860 1258.991,0.2025630 1259.473,0.3348880 1259.955,0.4122920 
1260.437,0.3575590 1260.919,0.4237960 1261.401,0.6853340 1261.883,0.9309230 
1262.365,0.8973420 1262.848,0.7383560 1263.330,0.6336200 1263.812,0.5750760 
1264.294,0.4186730 1264.776,8.4853999E-02 1265.258,4.6330001E-03 
1265.740,0.2656730 1266.222,0.5713410 1266.704,0.7061820 1267.187,0.7258260 
1267.669,0.6218810 1268.151,0.4450200 1268.633,0.3602470 1269.115,0.3703500 
1269.597,0.4505780 1270.079,0.6029420 1270.561,0.7061880 1271.043,0.6640510 
1271.526,0.5485020 1272.008,0.3648150 1272.490,0.1610260 
1272.972,1.0806000E-02 1273.454,0.1418650 1273.936,9.2528999E-02 
1274.418,0.1434630 1274.900,0.3750830 1275.383,0.4924980 1275.865,0.5619480 
1276.347,0.6275010 1276.829,0.6523910 1277.311,0.5109350 1277.793,0.2801630 
1278.275,0.3354880 1278.757,0.6638530 1279.239,0.8587910 1279.722,0.6439650 
1280.204,0.4297820 1280.686,0.2741350 1281.168,0.2009570 1281.650,0.2976490 
1282.132,0.4738670 1282.614,0.5438600 1283.096,0.4903720 1283.578,0.2947900 
1284.061,0.1303710 1284.543,3.4713998E-02 1285.025,2.4439000E-02 
1285.507,7.6086998E-02 1285.989,0.2175360 1286.471,0.3716830 
1286.953,0.4399210 1287.435,0.4323200 1287.917,0.3907650 1288.400,0.3073200 
1288.882,0.2946100 1289.364,0.3664400 1289.846,0.3987640 1290.328,0.2183460 
1290.810,2.3824999E-02 1291.292,2.3400001E-04 1291.774,6.9193996E-02 
1292.257,6.9375001E-02 1292.739,0.0000000E+00 
##MOLFORM=Al0.74 As3 Fe1.26 H23 Mg4.23 Mn8.06 O34 Zn0.71
##RESOLUTION=4
##PRESSURE=100
##TEMPERATURE=26.85
##END=
