##TITLE=1000164
##JCAMP-DX=4.24
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##SOURCE REFERENCE=http://solsa.crystallography.net/rod/1000164.rod
##OWNER=PUBLIC DOMAIN
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171.5912,27.96484 172.0734,27.77148 172.5555,27.06152 173.0376,24.68164 
173.5197,21.46094 174.0018,18.16992 174.4839,14.64746 174.9661,11.57617 
175.4482,13.40332 175.9303,27.56055 176.4124,38.47559 176.8945,40.31738 
177.3766,36.16309 177.8588,31.59277 178.3409,30.56445 178.8230,33.13379 
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183.1620,44.93457 183.6441,40.98535 184.1263,37.50586 184.6084,38.53711 
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335.5108,225.3457 335.9929,248.9648 336.4750,269.6562 336.9572,282.9316 
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339.3677,399.5449 339.8499,418.5908 340.3320,444.2588 340.8141,478.4814 
341.2962,514.3564 341.7783,547.9258 342.2604,583.3984 342.7426,626.8857 
343.2247,679.9551 343.7068,738.4307 344.1889,796.5186 344.6710,853.5518 
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347.0816,1148.073 347.5637,1173.778 348.0458,1176.608 348.5280,1155.943 
349.0101,1105.213 349.4922,1012.799 349.9743,907.9561 350.4564,795.8984 
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424.2202,207.2988 424.7023,213.3291 425.1844,213.8105 425.6666,210.0635 
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428.0771,229.0977 428.5593,235.9727 429.0414,241.5596 429.5235,246.4180 
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439.6479,360.7725 440.1301,371.6758 440.6122,384.2285 441.0943,400.5811 
441.5764,420.3750 442.0585,439.5645 442.5406,453.4746 443.0227,461.7773 
443.5049,467.6670 443.9870,472.7051 444.4691,473.6436 444.9512,468.9482 
445.4333,459.5713 445.9154,447.0410 446.3976,432.2695 446.8797,414.5186 
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449.2903,290.1650 449.7724,271.2344 450.2545,251.6543 450.7366,234.8604 
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453.1472,208.8408 453.6293,212.7520 454.1114,220.4043 454.5935,231.3320 
455.0757,247.5566 455.5578,262.7754 456.0399,271.7686 456.5220,275.2744 
457.0041,276.4014 457.4862,275.6426 457.9684,273.5928 458.4505,271.2480 
458.9326,268.7842 459.4147,264.0078 459.8968,259.7188 460.3789,250.7588 
460.8611,229.5439 461.3432,198.0508 461.8253,167.4990 462.3074,144.4941 
462.7895,127.7686 463.2716,111.4307 463.7538,93.95215 464.2359,78.84668 
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493.6450,13.38086 494.1271,14.55859 494.6092,17.08887 495.0913,19.83398 
495.5734,22.31836 496.0555,22.88965 496.5377,18.52344 497.0198,11.56836 
497.5019,8.914063 497.9840,11.40430 498.4661,14.80566 498.9482,17.89453 
499.4304,19.93457 499.9125,19.29785 500.3946,14.37695 500.8767,10.55273 
501.3588,11.02930 501.8409,14.26074 502.3231,17.96094 502.8052,21.61816 
503.2873,24.42969 503.7694,25.63672 504.2515,25.32812 504.7336,25.80664 
505.2158,26.57520 505.6979,28.49219 506.1800,33.61719 506.6621,39.26758 
507.1442,40.24316 507.6263,35.18457 508.1085,29.50391 508.5906,32.26855 
509.0727,47.37207 509.5548,56.28418 510.0369,53.23633 510.5190,49.82422 
511.0012,52.04492 511.4833,56.85938 511.9654,57.39355 512.4475,49.39551 
512.9296,38.29688 513.4117,34.48145 513.8939,38.97266 514.3760,42.79395 
514.8581,44.37793 515.3402,44.24316 515.8223,42.29004 516.3044,38.88965 
516.7866,36.26660 517.2687,35.27051 517.7508,35.60645 518.2329,37.19336 
518.7150,39.95312 519.1971,43.15918 519.6793,47.01270 520.1614,50.46875 
520.6435,50.88574 521.1256,47.57422 521.6077,43.91113 522.0898,40.05762 
522.5720,36.35742 523.0541,32.87988 523.5362,29.82520 524.0183,27.52344 
524.5004,26.08887 524.9825,25.83691 525.4647,28.65820 525.9468,41.22559 
526.4289,47.06738 526.9110,39.01367 527.3931,28.07617 527.8752,23.49316 
528.3574,26.04004 528.8395,30.20215 529.3216,31.05176 529.8037,29.15430 
530.2858,29.13672 530.7679,32.93359 531.2501,34.52539 531.7322,27.80469 
532.2143,19.13184 532.6964,15.57617 533.1785,18.87109 533.6606,22.80566 
534.1428,23.72852 534.6249,22.13477 535.1070,18.15527 535.5891,11.41113 
536.0712,6.134766 536.5533,6.265625 537.0355,11.28125 537.5176,15.38184 
537.9997,18.36426 538.4818,20.70117 538.9639,22.19922 539.4460,23.13574 
539.9282,24.25879 540.4103,25.63086 540.8924,25.83496 541.3745,22.21094 
541.8566,14.35352 542.3387,12.20410 542.8209,21.93652 543.3029,30.24707 
543.7850,34.76270 544.2672,36.37695 544.7493,35.63770 545.2314,32.85352 
545.7135,29.57617 546.1956,27.63770 546.6777,26.89648 547.1599,25.84668 
547.6420,24.23535 548.1241,22.73438 548.6062,20.79688 549.0883,19.48438 
549.5704,21.03809 550.0526,27.30273 550.5347,33.36621 551.0168,36.65625 
551.4989,37.44336 551.9810,35.87402 552.4631,31.92969 552.9453,27.04785 
553.4274,22.42188 553.9095,18.00391 554.3916,14.04980 554.8737,9.516602 
555.3558,6.533203 555.8380,6.881836 556.3201,8.527344 556.8022,9.039063 
557.2843,7.791016 557.7664,5.924805 558.2485,4.844727 558.7307,4.623047 
559.2128,3.137695 559.6949,1.338867 560.1770,4.448242 560.6591,3.259766 
561.1412,0.7050780 561.6234,0.7656250 562.1055,4.632813 562.5876,8.699219 
563.0697,10.29199 563.5518,9.559570 564.0339,6.340820 564.5161,4.8827998E-02 
564.9982,5.550781 565.4803,6.774414 565.9624,5.095703 566.4445,7.117188 
566.9266,16.92383 567.4088,24.56152 567.8909,24.68164 568.3730,21.68652 
568.8551,21.11035 569.3372,23.99609 569.8193,28.07227 570.3015,30.97852 
570.7836,32.57617 571.2657,33.23047 571.7478,30.75293 572.2299,30.47852 
572.7120,35.04199 573.1942,40.75781 573.6763,44.36328 574.1584,45.41113 
574.6405,45.22266 575.1226,44.27734 575.6047,42.93555 576.0869,42.31543 
576.5690,41.94629 577.0511,44.46191 577.5332,53.63770 578.0153,64.96191 
578.4974,71.64160 578.9796,73.41992 579.4617,71.28711 579.9438,60.41797 
580.4259,48.94629 580.9080,48.41016 581.3901,57.91504 581.8723,65.74023 
582.3544,64.06543 582.8365,56.15820 583.3186,53.09863 583.8007,59.52930 
584.2828,63.93848 584.7650,64.68262 585.2471,64.69824 585.7292,66.85742 
586.2113,70.24414 586.6934,70.79688 587.1755,64.93555 587.6577,56.48926 
588.1398,55.21289 588.6219,62.35449 589.1040,67.79492 589.5861,66.61816 
590.0682,65.59863 590.5504,72.24805 591.0325,85.46777 591.5146,97.13574 
591.9967,106.0801 592.4788,111.2705 592.9609,108.9102 593.4431,101.7002 
593.9252,98.54688 594.4073,103.2217 594.8894,110.3359 595.3715,111.6133 
595.8536,104.6992 596.3358,102.3525 596.8179,108.1787 597.3000,113.8828 
597.7821,117.4922 598.2642,118.8057 598.7463,116.9150 599.2285,111.6709 
599.7106,106.4785 600.1927,106.0078 600.6748,110.0664 601.1569,113.1445 
601.6390,115.2988 602.1212,115.7812 602.6033,113.1592 603.0854,108.8232 
603.5675,105.0146 604.0496,102.3281 604.5317,99.05762 605.0139,94.22852 
605.4960,88.30078 605.9781,81.25391 606.4602,73.42969 606.9423,67.19531 
607.4244,64.63672 607.9066,64.76416 608.3887,62.88916 608.8708,55.70801 
609.3529,51.43115 609.8350,53.54492 610.3171,56.04980 610.7993,54.57275 
611.2814,49.50635 611.7635,43.41748 612.2456,37.03174 612.7277,32.04102 
613.2098,34.02686 613.6920,44.07178 614.1741,48.10059 614.6562,39.48145 
615.1383,27.78613 615.6204,22.74219 616.1025,23.26367 616.5847,23.47217 
617.0668,21.68115 617.5489,19.41016 618.0310,17.80273 618.5131,16.82568 
618.9952,16.13379 619.4774,15.40137 619.9595,13.75781 620.4416,10.21875 
620.9237,4.722168 621.4058,0.9067380 621.8879,0.2480470 622.3701,0.1538090 
622.8522,0.1083980 623.3343,0.4160160 623.8164,0.4897460 624.2985,0.1660160 
624.7806,0.5205080 625.2628,2.404785 625.7448,4.382813 626.2269,2.710449 
626.7090,3.078125 627.1912,7.601563 627.6733,8.056641 628.1554,6.228516 
628.6375,5.579590 629.1196,6.470215 629.6017,6.640137 630.0839,5.997559 
630.5660,4.391113 631.0481,0.9799800 631.5302,3.386230 632.0123,7.031738 
632.4944,9.183594 632.9766,9.850098 633.4587,8.342773 633.9408,3.605957 
634.4229,2.175293 634.9050,6.862793 635.3871,11.36768 635.8693,12.69189 
636.3514,12.20361 636.8335,12.04883 637.3156,12.86719 637.7977,13.51025 
638.2798,12.10303 638.7620,10.32080 639.2441,12.62305 639.7262,19.26611 
640.2083,23.38037 640.6904,19.70020 641.1725,11.11914 641.6547,7.276855 
642.1368,12.35547 642.6189,16.19971 643.1010,17.78906 643.5831,19.01709 
644.0652,21.71094 644.5474,25.01807 645.0295,26.42090 645.5116,24.39307 
645.9937,20.93359 646.4758,19.30273 646.9579,19.48828 647.4401,19.80566 
647.9222,20.62402 648.4043,20.30615 648.8864,16.53662 649.3685,10.63477 
649.8506,6.802734 650.3328,5.078125 650.8149,6.003906 651.2970,12.99219 
651.7791,21.08496 652.2612,23.66748 652.7433,20.59521 653.2255,16.42236 
653.7076,14.29102 654.1897,14.13086 654.6718,15.71387 655.1539,19.10693 
655.6360,23.97754 656.1182,33.37354 656.6003,41.43604 657.0824,43.45166 
657.5645,41.20654 658.0466,40.63623 658.5287,45.00439 659.0109,50.08008 
659.4930,51.81592 659.9751,51.03857 660.4572,49.77002 660.9393,48.41406 
661.4214,47.60986 661.9036,47.78223 662.3857,49.01562 662.8678,51.94434 
663.3499,58.54199 663.8320,64.41113 664.3141,71.94482 664.7963,76.63379 
665.2784,71.74561 665.7605,60.06396 666.2426,52.73975 666.7247,58.06885 
667.2068,69.30664 667.6890,74.10205 668.1711,72.69141 668.6532,70.91113 
669.1353,69.15576 669.6174,69.18604 670.0995,74.14502 670.5817,83.46045 
671.0638,88.58350 671.5459,83.39062 672.0280,80.71484 672.5101,87.64014 
672.9922,96.62109 673.4744,98.97412 673.9565,94.72412 674.4386,90.71729 
674.9207,92.18799 675.4028,97.67334 675.8849,102.6636 676.3671,107.2456 
676.8492,110.8467 677.3313,112.7822 677.8134,114.3398 678.2955,116.4004 
678.7776,118.9292 679.2598,121.8833 679.7419,126.7358 680.2240,130.1914 
680.7061,129.3281 681.1882,126.2002 681.6703,123.7334 682.1525,122.5801 
682.6346,122.4546 683.1167,123.3457 683.5988,124.8462 684.0809,124.8428 
684.5630,122.4561 685.0452,119.9907 685.5273,115.6079 686.0094,113.8169 
686.4915,120.4966 686.9736,131.8867 687.4557,137.1074 687.9379,130.3066 
688.4200,119.2529 688.9021,108.0103 689.3842,98.09326 689.8663,94.65723 
690.3484,98.42383 690.8306,103.0537 691.3127,103.5444 691.7948,100.7729 
692.2769,99.20508 692.7590,100.7881 693.2411,100.6084 693.7233,98.12158 
694.2054,94.37646 694.6875,88.58398 695.1696,82.19727 695.6517,78.66455 
696.1339,80.05762 696.6160,83.10498 697.0981,84.77148 697.5802,85.09814 
698.0623,83.22754 698.5444,78.76562 699.0266,76.49951 699.5087,80.90137 
699.9908,89.39990 700.4729,92.09082 700.9550,84.06152 701.4371,77.42822 
701.9193,72.24561 702.4014,68.50391 702.8835,65.86621 703.3656,64.73193 
703.8477,66.47559 704.3298,72.00488 704.8120,77.93213 705.2941,79.94629 
705.7762,78.71436 706.2583,76.87793 706.7404,74.45312 707.2225,73.57422 
707.7046,76.68604 708.1867,81.28760 708.6688,80.61230 709.1509,72.20068 
709.6331,65.08789 710.1152,58.87402 710.5973,54.93115 711.0794,54.72852 
711.5615,57.14990 712.0436,60.74658 712.5258,64.91162 713.0079,68.41895 
713.4900,69.71094 713.9721,69.06201 714.4542,68.24170 714.9363,67.59570 
715.4185,64.75049 715.9006,57.08008 716.3827,48.31836 716.8648,45.53857 
717.3469,50.06104 717.8290,52.16309 718.3112,50.37109 718.7933,46.74316 
719.2754,41.36572 719.7575,35.21045 720.2396,28.94434 720.7217,23.01660 
721.2039,18.67236 721.6860,17.72314 722.1681,19.21387 722.6502,19.69580 
723.1323,19.23584 723.6144,17.00000 724.0966,11.95312 724.5787,6.224121 
725.0608,1.958496 725.5429,0.8559570 726.0250,1.517090 726.5071,3.989258 
726.9893,6.965820 727.4714,2.378418 727.9535,5.215332 728.4356,11.89355 
728.9177,16.26074 729.3998,16.58789 729.8820,10.75195 730.3641,2.377441 
730.8462,2.195313 731.3283,2.846680 731.8104,3.332031 732.2925,3.965820 
732.7747,6.016113 733.2568,10.58447 733.7389,17.37256 734.2210,25.21338 
734.7031,36.69824 735.1852,45.29443 735.6674,48.76514 736.1495,49.31543 
736.6316,47.34033 737.1137,44.09570 737.5958,42.14209 738.0779,42.74561 
738.5601,45.31885 739.0422,49.78027 739.5243,55.98193 740.0064,60.74951 
740.4885,63.54639 740.9706,64.53174 741.4528,63.02148 741.9349,60.74512 
742.4170,62.02148 742.8991,68.56104 743.3812,72.54248 743.8633,71.28613 
744.3455,69.65039 744.8276,70.74219 745.3097,72.70654 745.7918,72.51074 
746.2739,69.54883 746.7560,67.10498 747.2382,68.91406 747.7203,73.67139 
748.2024,77.48828 748.6845,80.36865 749.1666,82.28809 749.6487,82.65283 
750.1309,83.52930 750.6130,88.07812 751.0951,96.63428 751.5772,101.1143 
752.0593,98.30225 752.5414,95.76855 753.0236,96.12109 753.5057,96.60156 
753.9878,93.54492 754.4699,87.82031 754.9520,84.41602 755.4341,87.51709 
755.9163,91.16113 756.3984,84.09326 756.8805,69.71289 757.3626,64.93164 
757.8447,73.09766 758.3268,80.65674 758.8090,77.11621 759.2911,66.77002 
759.7732,64.10742 760.2553,76.43604 760.7374,83.46631 761.2195,81.72314 
761.7017,79.01074 762.1838,78.89600 762.6659,80.42480 763.1480,81.65771 
763.6301,82.08691 764.1122,82.67236 764.5944,83.79150 765.0765,85.68115 
765.5586,88.83350 766.0407,93.11523 766.5228,98.05078 767.0049,103.4780 
767.4871,108.5884 767.9692,111.9580 768.4513,113.3452 768.9334,117.7622 
769.4155,127.6802 769.8976,136.4126 770.3798,144.5161 770.8619,149.2920 
771.3440,147.0483 771.8261,138.9497 772.3082,131.1650 772.7903,126.0073 
773.2725,121.5957 773.7546,116.2510 774.2367,111.0532 774.7188,108.5410 
775.2009,108.4155 775.6830,107.1973 776.1652,102.5723 776.6473,95.45850 
777.1294,87.61279 777.6115,78.72314 778.0936,71.21826 778.5757,65.14307 
779.0579,60.74756 779.5400,59.73145 780.0221,59.85791 780.5042,57.38477 
780.9863,51.76025 781.4684,45.57178 781.9506,37.54150 782.4327,30.97607 
782.9148,28.67480 783.3969,28.97119 783.8790,29.73389 784.3611,30.23145 
784.8433,29.50342 785.3254,26.80908 785.8075,21.85547 786.2896,12.73340 
786.7717,0.5307620 787.2538,5.806152 787.7360,2.737793 788.2181,12.95020 
788.7002,12.68994 789.1823,3.200684 789.6644,3.346680 790.1465,5.827148 
790.6286,7.150879 791.1107,6.539063 791.5928,5.695313 792.0750,6.091797 
792.5571,7.080566 793.0392,7.158691 793.5213,5.743164 794.0034,3.598633 
794.4855,0.6132810 794.9677,2.327148 795.4498,3.445313 795.9319,2.774902 
796.4140,0.8618160 796.8961,2.284180 797.3782,4.521973 797.8604,2.383789 
798.3425,4.407227 798.8246,7.705566 799.3067,5.234375 799.7888,3.289551 
800.2709,4.705078 800.7531,6.135742 801.2352,4.020020 801.7173,0.6293950 
802.1994,2.482910 802.6815,1.270508 803.1636,6.032715 803.6458,9.421387 
804.1279,12.57861 804.6100,17.32227 805.0921,23.26318 805.5742,28.58984 
806.0563,32.35303 806.5385,34.69531 807.0206,35.45312 807.5027,34.78125 
807.9848,34.57227 808.4669,35.04102 808.9490,35.29834 809.4312,34.93506 
809.9133,34.20752 810.3954,33.63721 810.8775,33.41748 811.3596,31.95410 
811.8417,28.29932 812.3239,24.68408 812.8060,20.89404 813.2881,18.03467 
813.7702,17.68262 814.2523,19.43164 814.7344,21.06885 815.2166,21.07129 
815.6987,21.44531 816.1808,24.55420 816.6629,29.54736 817.1450,35.49414 
817.6271,41.81299 818.1093,45.32910 818.5914,44.01611 819.0735,39.87842 
819.5556,36.50342 820.0377,33.69189 820.5198,32.65869 821.0020,34.38916 
821.4841,35.83887 821.9662,36.07129 822.4483,35.28223 822.9304,32.78955 
823.4125,28.77246 823.8947,27.65234 824.3768,34.28613 824.8589,39.35107 
825.3410,36.55762 825.8231,31.64893 826.3052,32.08350 826.7874,37.12988 
827.2695,40.24561 827.7516,37.49512 828.2337,32.59912 828.7158,30.93994 
829.1979,31.68018 829.6801,31.24951 830.1622,29.33984 830.6443,26.95312 
831.1264,24.30029 831.6085,22.23047 832.0906,22.19922 832.5728,24.41650 
833.0549,26.92236 833.5370,31.22510 834.0191,33.45508 834.5012,31.66162 
834.9833,28.45508 835.4655,24.81201 835.9476,21.46094 836.4297,21.05127 
836.9118,27.45068 837.3939,32.14990 837.8760,27.17725 838.3582,20.29395 
838.8403,22.30469 839.3224,31.15674 839.8045,36.88281 840.2866,34.78857 
840.7687,29.56299 841.2509,27.07031 841.7330,27.04785 842.2151,28.30957 
842.6972,30.92969 843.1793,33.19727 843.6614,34.36133 844.1436,35.23145 
844.6257,36.72852 845.1078,38.65771 845.5899,40.04248 846.0720,37.65771 
846.5541,38.29004 847.0363,47.15674 847.5184,54.34033 848.0005,52.42676 
848.4826,44.58154 848.9647,38.32080 849.4468,35.55518 849.9290,34.26953 
850.4111,34.02100 850.8932,34.27051 851.3753,34.80127 851.8574,35.44727 
852.3395,35.65967 852.8217,35.30322 853.3038,35.36865 853.7859,37.41553 
854.2680,40.30859 854.7501,39.86426 855.2322,36.14453 855.7144,32.69971 
856.1965,29.93555 856.6786,28.99170 857.1607,31.56543 857.6428,36.16357 
858.1249,37.91455 858.6071,35.07568 859.0892,32.98096 859.5713,31.43359 
860.0534,30.54346 860.5355,30.94385 861.0176,31.93604 861.4998,32.79541 
861.9819,33.45166 862.4640,34.53613 862.9461,37.40918 863.4282,39.53223 
863.9103,39.21875 864.3925,37.08057 864.8746,32.84717 865.3567,27.44824 
865.8388,24.60059 866.3209,26.75049 866.8030,30.30811 867.2852,28.76660 
867.7673,23.51855 868.2494,22.53809 868.7315,26.72168 869.2136,30.74072 
869.6957,31.58984 870.1779,30.88867 870.6600,30.18457 871.1421,29.49756 
871.6242,27.63477 872.1063,22.69678 872.5884,19.92432 873.0705,21.28564 
873.5526,24.03271 874.0347,27.74707 874.5168,31.55176 874.9990,33.13281 
875.4811,31.53076 875.9632,29.56396 876.4453,28.15869 876.9274,26.79150 
877.4095,25.03027 877.8917,23.06250 878.3738,20.55176 878.8559,17.83594 
879.3380,17.55713 879.8201,23.85938 880.3022,31.31641 880.7844,28.02783 
881.2665,17.98926 881.7486,17.45264 882.2307,28.47461 882.7128,39.56836 
883.1949,43.61084 883.6771,42.66797 884.1592,40.38916 884.6413,36.27393 
885.1234,34.58789 885.6055,35.95410 886.0876,39.50684 886.5698,47.02393 
887.0519,53.75146 887.5340,53.58252 888.0161,46.92236 888.4982,41.48779 
888.9803,37.39893 889.4625,35.06641 889.9446,35.08594 890.4267,36.66455 
890.9088,40.25928 891.3909,44.42041 891.8730,46.12012 892.3552,44.33545 
892.8373,43.52344 893.3194,52.01416 893.8015,58.88184 894.2836,47.81006 
894.7657,27.46143 895.2479,16.19482 895.7300,17.18359 896.2121,21.78564 
896.6942,24.34717 897.1763,25.56250 897.6584,24.68213 898.1406,22.13184 
898.6227,23.07227 899.1048,28.25342 899.5869,33.11572 900.0690,35.73633 
900.5511,36.24463 901.0333,34.80713 901.5154,31.34229 901.9975,27.32080 
902.4796,20.92236 902.9617,17.33545 903.4438,17.91992 903.9260,21.33105 
904.4081,29.60791 904.8902,39.69580 905.3723,42.98633 905.8544,35.49951 
906.3365,29.98828 906.8187,31.20166 907.3008,33.49365 907.7829,34.56689 
908.2650,34.09717 908.7471,30.88574 909.2292,25.48779 909.7114,21.76855 
910.1935,22.39258 910.6756,24.97266 911.1577,28.98145 911.6398,32.43164 
912.1219,29.98193 912.6041,22.76416 913.0862,18.66064 913.5683,21.45410 
914.0504,25.57568 914.5325,22.78955 915.0146,14.68555 915.4968,10.37256 
915.9789,9.999512 916.4610,10.75488 916.9431,12.05811 917.4252,14.27979 
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919.8358,26.41602 920.3179,32.43799 920.8000,34.91553 921.2822,26.87793 
921.7643,16.04395 922.2464,11.03516 922.7285,11.72900 923.2106,12.34082 
923.6927,11.32861 924.1749,11.22070 924.6570,15.72510 925.1391,18.21191 
925.6212,9.532715 926.1033,4.199707 926.5854,8.770996 927.0676,0.2143550 
927.5497,9.104492 928.0318,8.070801 928.5139,3.580078 928.9960,1.550293 
929.4781,1.151855 929.9603,0.2333980 930.4424,2.420898 930.9245,1.442383 
931.4066,5.727539 931.8887,13.67090 932.3708,12.57666 932.8530,4.895020 
933.3351,0.9335940 933.8172,1.066895 934.2993,1.490234 934.7814,0.5727540 
935.2635,1.368164 935.7457,8.196777 936.2278,19.06689 936.7099,21.23779 
937.1920,11.97461 937.6741,5.864258 938.1563,5.274414 938.6384,6.383789 
939.1205,7.880859 939.6026,9.096680 940.0847,8.323730 940.5668,4.704102 
941.0490,4.330078 941.5311,13.77051 942.0132,17.39795 942.4953,5.838867 
942.9774,6.634277 943.4595,8.494629 943.9417,2.939453 944.4238,0.3911130 
944.9059,1.250000 945.3880,1.624023 945.8701,4.661621 946.3522,9.589844 
946.8344,5.545898 947.3165,1.839355 947.7986,4.238770 948.2807,1.305664 
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950.6913,3.400391 951.1734,4.426270 951.6555,1.685547 952.1376,3.856934 
952.6198,11.30713 953.1019,15.26709 953.5840,8.967773 954.0661,2.479492 
954.5482,6.078125 955.0303,3.009277 955.5124,1.030273 955.9945,1.209473 
956.4766,1.535156 956.9587,0.8154300 957.4409,0.1503910 957.9230,1.473633 
958.4051,4.722656 958.8872,7.357910 959.3693,9.325684 959.8514,10.80420 
960.3336,11.65771 960.8157,12.53369 961.2978,14.50586 961.7799,16.49707 
962.2620,15.04980 962.7441,7.726074 963.2263,4.542969 963.7084,7.549805 
964.1905,12.03760 964.6726,19.25928 965.1547,25.42041 965.6368,27.14746 
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971.9044,5.863770 972.3865,5.111328 972.8686,7.424316 973.3507,6.451660 
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977.6898,4.631348 978.1719,2.224121 978.6540,2.121582 979.1361,5.541992 
979.6182,9.229004 980.1003,8.938965 980.5825,5.730957 981.0646,1.581055 
981.5467,2.796875 982.0288,0.4755860 982.5109,12.94971 982.9930,21.68018 
983.4752,17.55762 983.9573,7.402344 984.4394,5.628906 984.9215,13.19385 
985.4036,13.98193 985.8857,6.250488 986.3679,2.303223 986.8500,6.689941 
987.3321,10.99902 987.8142,7.182617 988.2963,1.011719 988.7784,0.3808590 
989.2606,13.69482 989.7427,20.13281 990.2248,15.39160 990.7069,9.408691 
991.1890,3.074707 991.6711,0.8198240 992.1533,1.623535 992.6354,9.160645 
993.1175,14.50977 993.5996,17.45312 994.0817,18.72168 994.5638,16.96777 
995.0460,15.07715 995.5281,13.70117 996.0102,13.12646 996.4923,14.40869 
996.9744,17.07227 997.4565,17.68115 997.9387,13.01123 998.4208,10.53223 
998.9029,14.04395 999.3850,18.34814 999.8671,21.05029 1000.349,21.88525 
1000.831,19.59131 1001.313,14.93311 1001.796,12.01025 1002.278,12.99268 
1002.760,14.38721 1003.242,14.51465 1003.724,14.56836 1004.206,14.27637 
1004.688,14.81055 1005.170,19.85400 1005.653,29.40332 1006.135,34.74023 
1006.617,26.16797 1007.099,15.95605 1007.581,17.27734 1008.063,23.82275 
1008.545,26.28809 1009.027,24.94580 1009.509,23.72949 1009.992,23.90771 
1010.474,25.68018 1010.956,31.55322 1011.438,37.92676 1011.920,37.24219 
1012.402,32.04346 1012.884,29.39062 1013.366,29.85205 1013.849,31.16455 
1014.331,32.31543 1014.813,33.69971 1015.295,36.19727 1015.777,38.92432 
1016.259,38.16895 1016.741,35.25488 1017.223,37.54541 1017.705,45.56787 
1018.188,52.38965 1018.670,54.40527 1019.152,54.27832 1019.634,55.76855 
1020.116,58.24512 1020.598,58.27295 1021.080,55.98730 1021.562,54.13916 
1022.044,53.10645 1022.527,54.65820 1023.009,60.07031 1023.491,67.19287 
1023.973,72.78662 1024.455,76.86914 1024.937,79.36768 1025.419,80.13574 
1025.901,80.44629 1026.384,80.20312 1026.866,81.30566 1027.348,85.52930 
1027.830,90.54199 1028.312,91.54639 1028.794,88.25488 1029.276,88.42139 
1029.758,93.49365 1030.240,96.44678 1030.723,94.28174 1031.205,94.02002 
1031.687,101.4746 1032.169,112.3848 1032.651,117.5107 1033.133,115.7339 
1033.615,119.0244 1034.097,130.3477 1034.579,139.3931 1035.062,143.1470 
1035.544,145.6895 1036.026,149.6992 1036.508,154.4873 1036.990,157.7954 
1037.472,158.7368 1037.954,161.1484 1038.436,167.1616 1038.919,171.4146 
1039.401,169.5562 1039.883,169.3149 1040.365,177.3076 1040.847,189.6006 
1041.329,197.5527 1041.811,200.2183 1042.293,203.8779 1042.776,210.3979 
1043.258,215.7686 1043.740,217.1958 1044.222,219.2197 1044.704,225.6128 
1045.186,234.4697 1045.668,241.7251 1046.150,246.6729 1046.632,252.8276 
1047.115,261.4971 1047.597,270.1660 1048.079,276.3848 1048.561,284.0952 
1049.043,298.5332 1049.525,315.4854 1050.007,326.7930 1050.489,330.9819 
1050.971,335.4399 1051.454,341.6440 1051.936,348.1660 1052.418,355.1768 
1052.900,361.6929 1053.382,367.1147 1053.864,371.4878 1054.346,375.1382 
1054.828,378.1348 1055.311,379.4561 1055.793,378.9937 1056.275,376.5903 
1056.757,370.6665 1057.239,364.2949 1057.721,360.9268 1058.203,358.3428 
1058.685,351.6216 1059.167,340.1621 1059.650,330.7627 1060.132,328.1465 
1060.614,324.5947 1061.096,316.9155 1061.578,307.4092 1062.060,297.6685 
1062.542,287.3242 1063.024,274.6353 1063.506,259.7427 1063.989,247.5435 
1064.471,241.6802 1064.953,236.0991 1065.435,229.9775 1065.917,221.5122 
1066.399,208.1631 1066.881,192.1646 1067.363,175.8555 1067.846,160.2271 
1068.328,147.8364 1068.810,142.0532 1069.292,135.5488 1069.774,121.0469 
1070.256,109.0859 1070.738,112.5137 1071.220,120.7798 1071.703,116.7075 
1072.185,100.3472 1072.667,87.94775 1073.149,86.99902 1073.631,86.93066 
1074.113,83.24805 1074.595,78.60303 1075.077,74.80713 1075.559,71.27539 
1076.042,66.87744 1076.524,61.72510 1077.006,57.01465 1077.488,53.20654 
1077.970,49.65332 1078.452,44.14355 1078.934,40.86768 1079.416,46.34326 
1079.898,53.06592 1080.380,50.04395 1080.863,39.72363 1081.345,34.35352 
1081.827,38.85840 1082.309,42.62744 1082.791,41.68066 1083.273,38.43799 
1083.755,32.20508 1084.237,26.09814 1084.720,23.17432 1085.202,23.20312 
1085.684,25.15430 1086.166,29.02197 1086.648,31.64502 1087.130,31.66943 
1087.612,30.13232 1088.094,26.55762 1088.577,22.46924 1089.059,18.41846 
1089.541,15.30029 1090.023,15.38232 1090.505,19.14307 1090.987,21.11182 
1091.469,18.61377 1091.951,14.85693 1092.433,11.13281 1092.916,6.882324 
1093.398,0.2202150 1093.880,6.512207 1094.362,9.010742 1094.844,6.947754 
1095.326,5.063477 1095.808,5.714355 1096.290,5.374512 1096.772,1.234375 
1097.255,2.399414 1097.737,1.213379 1098.219,1.164063 1098.701,1.650879 
1099.183,8.890625 1099.665,11.79004 1100.147,4.493652 1100.629,0.8808590 
1101.112,1.241699 1101.594,3.902832 1102.076,2.591797 1102.558,0.9663090 
1103.040,3.932129 1103.522,10.17529 1104.004,13.54590 1104.486,11.59277 
1104.969,10.38525 1105.451,13.21875 1105.933,14.88281 1106.415,10.02197 
1106.897,6.131348 1107.379,12.75830 1107.861,24.69482 1108.343,27.48486 
1108.825,17.38818 1109.307,13.63525 1109.790,25.41260 1110.272,32.93506 
1110.754,30.03564 1111.236,24.15430 1111.718,18.52344 1112.200,13.44531 
1112.682,8.980957 1113.164,5.095215 1113.647,3.643066 1114.129,7.131348 
1114.611,8.886230 1115.093,6.884277 1115.575,5.395996 1116.057,6.761719 
1116.539,9.081543 1117.021,10.31299 1117.504,10.50879 1117.986,10.11816 
1118.468,9.057617 1118.950,7.546387 1119.432,5.212891 1119.914,3.105957 
1120.396,0.9804690 1120.878,1.0254000E-02 1121.360,1.487793 1121.843,4.688965 
1122.325,7.569824 1122.807,10.62402 1123.289,9.916504 1123.771,3.701660 
1124.253,1.9531000E-02 1124.735,1.252930 1125.217,2.760742 1125.699,1.048828 
1126.182,1.133789 1126.664,1.616699 1127.146,8.793945 1127.628,10.50635 
1128.110,6.099609 1128.592,1.650879 1129.074,2.296875 1129.556,4.439941 
1130.039,4.168945 1130.521,1.798828 1131.003,2.719727 1131.485,8.383301 
1131.967,11.75391 1132.449,12.86426 1132.931,12.01807 1133.413,9.311035 
1133.896,7.812012 1134.378,8.452637 1134.860,8.852051 1135.342,7.023438 
1135.824,4.569824 1136.306,4.416016 1136.788,6.115723 1137.270,9.193359 
1137.752,12.65527 1138.234,9.888672 1138.717,1.150391 1139.199,2.279297 
1139.681,5.383301 1140.163,15.84082 1140.645,20.95117 1141.127,21.63330 
1141.609,17.88818 1142.091,11.78418 1142.574,7.291992 1143.056,4.949219 
1143.538,5.020508 1144.020,7.280273 1144.502,9.335449 1144.984,9.047852 
1145.466,8.915039 1145.948,13.29541 1146.431,17.91406 1146.913,16.13721 
1147.395,10.99268 1147.877,8.154785 1148.359,8.456543 1148.841,10.36865 
1149.323,13.59766 1149.805,16.06445 1150.287,16.51855 1150.770,15.66602 
1151.252,12.85156 1151.734,9.678223 1152.216,8.733398 1152.698,9.329590 
1153.180,8.430176 1153.662,5.284180 1154.144,3.809082 1154.626,6.866211 
1155.109,9.872070 1155.591,13.43799 1156.073,14.17920 1156.555,6.229980 
1157.037,3.201172 1157.519,3.483887 1158.001,4.248047 1158.483,8.246582 
1158.966,5.942383 1159.448,3.263672 1159.930,0.1669920 1160.412,3.010742 
1160.894,5.984863 1161.376,6.988770 1161.858,2.866211 1162.340,3.346191 
1162.822,4.648926 1163.305,0.3447270 1163.787,0.9853520 1164.269,2.021484 
1164.751,3.809082 1165.233,3.219238 1165.715,2.763184 1166.197,3.433594 
1166.679,4.970215 1167.161,7.084473 1167.644,9.978516 1168.126,15.05957 
1168.608,22.51953 1169.090,25.28760 1169.572,22.93408 1170.054,19.19775 
1170.536,15.01367 1171.018,13.89404 1171.500,18.65283 1171.983,25.17969 
1172.465,26.82129 1172.947,24.81494 1173.429,22.20166 1173.911,19.72949 
1174.393,20.69531 1174.875,24.87988 1175.357,29.75293 1175.840,34.10596 
1176.322,35.39062 1176.804,29.91699 1177.286,24.02686 1177.768,27.04102 
1178.250,33.60107 1178.732,36.37402 1179.214,36.37744 1179.697,36.29883 
1180.179,36.58545 1180.661,36.39551 1181.143,35.20850 1181.625,34.82959 
1182.107,37.47363 1182.589,40.43994 1183.071,40.13672 1183.553,39.44922 
1184.036,43.65527 1184.518,49.88525 1185.000,50.93066 1185.482,46.31934 
1185.964,43.89453 1186.446,47.97803 1186.928,49.16211 1187.410,40.68896 
1187.892,35.61572 1188.375,44.17920 1188.857,55.23291 1189.339,57.30225 
1189.821,53.52734 1190.303,54.27246 1190.785,60.91309 1191.267,63.88184 
1191.749,61.35059 1192.232,60.45215 1192.714,62.92725 1193.196,65.01855 
1193.678,64.43262 1194.160,63.68750 1194.642,65.92334 1195.124,70.46338 
1195.606,74.54346 1196.089,78.17139 1196.571,84.48291 1197.053,93.08838 
1197.535,95.72559 1198.017,90.32861 1198.499,85.18994 1198.981,85.46582 
1199.463,88.32080 1199.945,90.34814 1200.427,92.07520 1200.910,94.65088 
1201.392,97.75146 1201.874,101.6592 1202.356,105.2549 1202.838,104.6055 
1203.320,99.41309 1203.802,95.26855 1204.284,95.03223 1204.767,97.92529 
1205.249,106.2720 1205.731,114.3643 1206.213,118.4702 1206.695,118.7832 
1207.177,112.3657 1207.659,103.4180 1208.141,103.6626 1208.624,116.1909 
1209.106,123.3296 1209.588,117.3252 1210.070,110.8438 1210.552,103.3564 
1211.034,99.71240 1211.516,106.6528 1211.998,114.7246 1212.480,113.0469 
1212.963,104.8926 1213.445,103.2300 1213.927,109.7964 1214.409,113.7563 
1214.891,114.6025 1215.373,113.2217 1215.855,109.7368 1216.337,105.8174 
1216.819,102.4731 1217.302,99.24121 1217.784,95.37256 1218.266,91.30273 
1218.748,88.63477 1219.230,87.23193 1219.712,86.24365 1220.194,85.41943 
1220.676,82.52881 1221.159,77.52979 1221.641,74.29053 1222.123,75.21436 
1222.605,75.72070 1223.087,69.08203 1223.569,61.70557 1224.051,62.45801 
1224.533,65.72803 1225.016,63.25781 1225.498,57.65186 1225.980,55.45996 
1226.462,57.28711 1226.944,58.82422 1227.426,58.67529 1227.908,57.67529 
1228.390,55.62891 1228.872,53.14551 1229.354,50.07520 1229.837,46.78467 
1230.319,43.40723 1230.801,40.27295 1231.283,38.21045 1231.765,37.26074 
1232.247,34.04346 1232.729,26.48633 1233.211,23.51172 1233.694,27.02344 
1234.176,30.03906 1234.658,30.81494 1235.140,28.95801 1235.622,23.81250 
1236.104,17.30469 1236.586,12.38379 1237.068,9.145996 1237.551,8.833496 
1238.033,10.43994 1238.515,9.323242 1238.997,5.431152 1239.479,8.9844003E-02 
1239.961,6.128906 1240.443,7.619629 1240.925,0.2690430 1241.407,7.016113 
1241.890,5.193848 1242.372,0.3154300 1242.854,6.782715 1243.336,11.69873 
1243.818,12.17725 1244.300,8.830566 1244.782,1.717773 1245.264,8.396484 
1245.746,12.97168 1246.229,4.368652 1246.711,0.1357420 1247.193,6.397461 
1247.675,13.15039 1248.157,17.37598 1248.639,20.50244 1249.121,23.36426 
1249.603,25.90771 1250.085,28.12695 1250.568,29.97021 1251.050,30.61084 
1251.532,29.79541 1252.014,30.38525 1252.496,32.63477 1252.978,34.66162 
1253.460,35.90820 1253.942,38.58984 1254.425,44.30420 1254.907,51.20215 
1255.389,57.62988 1255.871,62.70801 1256.353,64.08643 1256.835,63.21289 
1257.317,62.08643 1257.799,61.32227 1258.281,61.64600 1258.764,63.11914 
1259.246,64.90479 1259.728,66.35352 1260.210,69.33350 1260.692,77.40576 
1261.174,83.44385 1261.656,83.95020 1262.138,81.59033 1262.620,75.10889 
1263.103,67.74170 1263.585,63.67871 1264.067,58.89062 1264.549,55.72705 
1265.031,62.17871 1265.513,66.24951 1265.995,62.75488 1266.477,60.61523 
1266.960,61.26172 1267.442,61.37598 1267.924,59.20459 1268.406,55.64307 
1268.888,51.30469 1269.370,47.18701 1269.852,46.60693 1270.334,47.64600 
1270.817,45.10010 1271.299,39.92529 1271.781,34.89062 1272.263,30.79834 
1272.745,28.24463 1273.227,27.48633 1273.709,26.61621 1274.191,24.51416 
1274.673,22.37939 1275.156,21.37988 1275.638,20.24463 1276.120,16.59033 
1276.602,13.55859 1277.084,17.26367 1277.566,24.19922 1278.048,22.05518 
1278.530,9.266602 1279.012,2.201172 1279.495,1.590820 1279.977,4.022461 
1280.459,10.44922 1280.941,13.72363 1281.423,10.90186 1281.905,7.710938 
1282.387,8.879395 1282.869,11.52344 1283.352,10.62646 1283.834,7.297363 
1284.316,3.486328 1284.798,0.0000000E+00 
##MOLFORM=Be H2 O2
##RESOLUTION=4
##PRESSURE=100
##TEMPERATURE=26.85
##END=
