##TITLE=1000013
##JCAMP-DX=4.24
##DATA TYPE=RAMAN SPECTRUM
##SOURCE REFERENCE=http://solsa.crystallography.net/rod/1000013.rod
##OWNER=PUBLIC DOMAIN
##XUNITS=1/CM
##YUNITS=ARBITRARY UNITS
##FIRSTX=82.1123
##LASTX=3820
##XFACTOR=1
##YFACTOR=1
##NPOINTS=1945
##FIRSTY=1215.8
##LASTY=2294.52
##XYPOINTS=(XY..XY)
82.1123,1215.8 84.0351,1253.79 85.9579,1291.79 87.8807,1275.11 89.8034,1202.76 
91.7262,1130.4 93.649,1127.85 95.5718,1125.76 97.4946,1147.83 99.4173,1194.91 
101.34,1241.99 103.263,1266.21 105.186,1290.24 107.108,1308.04 109.031,1319.39 
110.954,1330.75 112.877,1304.77 114.8,1278.62 116.722,1251.7 118.645,1224.03 
120.568,1196.37 122.491,1170.92 124.414,1145.46 126.336,1110.22 
128.259,1065.56 130.182,1021.79 132.105,1026.42 134.027,1031.05 135.95,1015.28 
137.873,981.193 139.796,946.9 141.719,907.384 143.641,867.868 145.564,839.363 
147.487,819.912 149.41,799.801 151.332,769.606 153.255,739.412 155.178,714.146 
157.101,692.517 159.024,671.626 160.946,658.127 162.869,644.628 
164.792,630.863 166.715,616.927 168.637,604.658 170.56,603.939 172.483,603.221 
174.406,591.918 176.329,574.791 178.251,558.843 180.174,548.861 
182.097,538.879 184.02,536.069 185.943,536.517 187.865,536.048 189.788,532.14 
191.711,528.232 193.634,536.95 195.556,550.214 197.479,558.017 199.402,550.306 
201.325,542.596 203.248,548.44 205.17,557.934 207.093,569.053 209.016,583.7 
210.939,598.347 212.861,602.977 214.784,605.774 216.707,611.979 218.63,623.835 
220.553,635.69 222.475,635.513 224.398,634.11 226.321,631.232 228.244,626.487 
230.167,621.742 232.089,628.001 234.012,634.533 235.935,638.02 237.858,638.6 
239.78,639.235 241.703,640.928 243.626,642.62 245.549,636.538 247.472,624.993 
249.394,614.843 251.317,614.28 253.24,613.717 255.163,603.334 257.085,588.067 
259.008,572.537 260.931,556.015 262.854,539.494 264.777,536.907 266.699,538.86 
268.622,536.803 270.545,525.334 272.468,513.866 274.39,495.833 276.313,476.592 
278.236,459.138 280.159,444.454 282.082,429.769 284.004,441.403 
285.927,454.699 287.85,453.705 289.773,437.899 291.696,422.045 293.618,405.102 
295.541,388.159 297.464,395.117 299.387,418.384 301.309,436.849 
303.232,427.522 305.155,418.196 307.078,421.303 309.001,429.674 
310.923,432.748 312.846,420.669 314.769,408.591 316.692,410.345 
318.614,415.203 320.537,416.11 322.46,410.414 324.383,404.718 326.306,395.708 
328.228,386.467 330.151,387.788 332.074,399.854 333.997,410.371 
335.919,395.848 337.842,381.324 339.765,390.406 341.688,413.843 
343.611,433.969 345.533,439.785 347.456,445.6 349.379,444.544 351.302,441.245 
353.225,439.466 355.147,440.9 357.07,442.334 358.993,440.335 360.916,437.91 
362.838,430.997 364.761,418.821 366.684,407.357 368.607,418.047 370.53,428.737 
372.452,439.593 374.375,450.557 376.298,458.154 378.221,450.143 
380.143,442.132 382.066,443.119 383.989,447.058 385.912,449.538 
387.835,449.032 389.757,448.527 391.68,441.568 393.603,433.943 395.526,431.718 
397.449,435.241 399.371,439.242 401.294,450.148 403.217,461.055 405.14,460.456 
407.062,453.554 408.985,447.163 410.908,442.499 412.831,437.835 
414.754,437.965 416.676,439.202 418.599,441.607 420.522,445.781 
422.445,449.956 424.367,446.293 426.29,442.499 428.213,446.197 430.136,455.528 
432.059,465.568 433.981,479.355 435.904,493.142 437.827,499.134 439.75,502.516 
441.672,504.588 443.595,504.117 445.518,503.646 447.441,497.798 
449.364,491.566 451.286,493.343 453.209,502.329 455.132,510.172 457.055,509.7 
458.978,509.228 460.9,511.927 462.823,515.874 464.746,518.824 466.669,519.596 
468.591,520.367 470.514,524.84 472.437,529.664 474.36,538.951 476.283,552.471 
478.205,564.317 480.128,563.111 482.051,561.905 483.974,560.624 
485.896,559.313 487.819,562.14 489.742,573.766 491.665,585.392 493.588,571.767 
495.51,556.052 497.433,546.852 499.356,543.438 501.279,541.578 503.202,549.517 
505.124,557.456 507.047,552.522 508.97,543.185 510.893,543.765 512.815,562.395 
514.738,581.025 516.661,577.873 518.584,573.938 520.507,575.291 522.429,580.52 
524.352,581.468 526.275,564.316 528.198,547.164 530.12,549.443 532.043,556.419 
533.966,559.419 535.889,556.945 537.812,554.774 539.734,560.454 
541.657,566.134 543.58,572.202 545.503,578.474 547.425,582.589 549.348,581.004 
551.271,579.42 553.194,584.98 555.117,591.371 557.039,588.696 558.962,577.543 
560.885,567.376 562.808,563.258 564.731,559.139 566.653,570.248 
568.576,586.074 570.499,593.453 572.422,587.573 574.344,582.054 
576.267,598.768 578.19,615.483 580.113,626.047 582.036,633.211 583.958,639.13 
585.881,641.713 587.804,644.297 589.727,648.756 591.649,653.419 593.572,653.51 
595.495,649.603 597.418,646.126 599.341,644.812 601.263,643.498 
603.186,646.456 605.109,650.482 607.032,659.38 608.955,674.589 610.877,689.752 
612.8,704.315 614.723,718.878 616.646,708.576 618.568,688.054 620.491,675.975 
622.414,679.79 624.337,683.604 626.26,679.255 628.182,674.802 630.105,675.002 
632.028,677.96 633.951,682.311 635.873,690.438 637.796,698.564 639.719,690.837 
641.642,681.608 643.565,680.196 645.487,684.989 647.41,687.071 649.333,678.551 
651.256,670.031 653.178,684.243 655.101,702.438 657.024,708.771 
658.947,703.155 660.87,700.32 662.792,713.519 664.715,726.717 666.638,733.217 
668.561,738.027 670.484,741.734 672.406,744.093 674.329,746.17 676.252,745.794 
678.175,745.416 680.097,757.177 682.02,772.825 683.943,784.203 685.866,789.501 
687.789,795.158 689.711,805.669 691.634,816.18 693.557,812.993 695.48,804.647 
697.402,804.483 699.325,817.326 701.248,830.066 703.171,840.647 
705.094,851.227 707.016,861.581 708.939,871.84 710.862,879.548 712.785,882.908 
714.708,886.748 716.63,904.713 718.553,922.678 720.476,938.651 722.399,953.763 
724.321,963.338 726.244,963.217 728.167,963.406 730.09,973.269 732.013,983.132 
733.935,977.553 735.858,965.348 737.781,952.614 739.704,938.974 741.626,926.96 
743.549,954.724 745.472,982.488 747.395,977.145 749.318,958.366 751.24,954.343 
753.163,973.951 755.086,992.642 757.009,996.635 758.931,1000.63 
760.854,1013.39 762.777,1029.33 764.7,1037.54 766.623,1034.64 768.545,1033.05 
770.468,1045.03 772.391,1057.01 774.314,1064.05 776.237,1069.6 778.159,1080.54 
780.082,1098.16 782.005,1114.75 783.928,1124.35 785.85,1133.94 787.773,1128.01 
789.696,1118.44 791.619,1120.36 793.542,1134.06 795.464,1148.36 
797.387,1165.41 799.31,1182.45 801.233,1200.05 803.155,1217.73 805.078,1234.72 
807.001,1251.14 808.924,1264.08 810.847,1266.03 812.769,1267.98 
814.692,1278.79 816.615,1290.27 818.538,1292.65 820.461,1289.47 
822.383,1286.04 824.306,1282.1 826.229,1278.28 828.152,1300.63 830.074,1322.98 
831.997,1340.94 833.92,1357.02 835.843,1378.96 837.766,1409.9 839.688,1438.96 
841.611,1449.1 843.534,1459.25 845.457,1477.13 847.379,1497.08 849.302,1513.62 
851.225,1526.58 853.148,1536.61 855.071,1533.83 856.993,1531.06 
858.916,1526.52 860.839,1521.77 862.762,1528.14 864.684,1542.28 
866.607,1553.94 868.53,1559.57 870.453,1565.21 872.376,1557.09 874.298,1548.92 
876.221,1546.77 878.144,1547.16 880.067,1552.08 881.99,1563.52 883.912,1577.04 
885.835,1606.23 887.758,1635.42 889.681,1635.96 891.603,1630.46 
893.526,1609.85 895.449,1576.18 897.372,1541.57 899.295,1504.13 
901.217,1466.69 903.14,1446.07 905.063,1426.14 906.986,1414.4 908.908,1406.63 
910.831,1406.07 912.754,1416.86 914.677,1426.45 916.6,1425.68 918.522,1424.92 
920.445,1424.85 922.368,1424.94 924.291,1418.52 926.214,1406.55 
928.136,1400.73 930.059,1412.57 931.982,1424.41 933.905,1432.36 
935.827,1440.22 937.75,1444.03 939.673,1446.11 941.596,1449.79 943.518,1455.64 
945.441,1462.31 947.364,1473.69 949.287,1485.07 951.21,1490.24 953.132,1494.51 
955.055,1505.17 956.978,1520.11 958.901,1533.9 960.824,1545.32 962.746,1558.23 
964.669,1596.32 966.592,1634.42 968.515,1658.52 970.437,1678.77 972.36,1679.26 
974.283,1661.19 976.206,1639.9 978.129,1608.81 980.051,1577.72 981.974,1574.32 
983.897,1571.48 985.82,1566.55 987.742,1560.79 989.665,1545.31 991.588,1517.9 
993.511,1498.55 995.434,1514.6 997.356,1530.65 999.279,1549.81 1001.2,1569.23 
1003.12,1598.5 1005.05,1632.77 1006.97,1656.01 1008.89,1662.85 1010.82,1671.43 
1012.74,1690.35 1014.66,1709.27 1016.58,1737.25 1018.51,1766.4 1020.43,1778.79 
1022.35,1781.29 1024.28,1786.81 1026.2,1797.44 1028.12,1805.94 1030.04,1798.57 
1031.97,1791.19 1033.89,1792.85 1035.81,1795.93 1037.73,1800.95 1039.66,1807.2 
1041.58,1814.61 1043.5,1824.08 1045.43,1836.89 1047.35,1876.46 1049.27,1916.04 
1051.19,1971.26 1053.12,2028.99 1055.04,2141.59 1056.96,2288.65 
1058.89,2429.61 1060.81,2560.1 1062.73,2664.39 1064.65,2580.62 1066.58,2496.84 
1068.5,2406.14 1070.42,2314.47 1072.34,2272.98 1074.27,2260.42 1076.19,2251.7 
1078.11,2248.93 1080.04,2244.65 1081.96,2231.92 1083.88,2219.19 1085.8,2157.58 
1087.73,2091.16 1089.65,2065.57 1091.57,2059.89 1093.5,2052.88 1095.42,2044.12 
1097.34,2037.19 1099.26,2037.72 1101.19,2038.24 1103.11,2015.62 
1105.03,1992.09 1106.95,1974.17 1108.88,1958.36 1110.8,1941.13 1112.72,1922.45 
1114.65,1916.91 1116.57,1948.44 1118.49,1980.48 1120.41,2029.43 
1122.34,2078.38 1124.26,2129.52 1126.18,2181.21 1128.11,2181.46 
1130.03,2143.14 1131.95,2071.69 1133.87,1937 1135.8,1810.03 1137.72,1741.17 
1139.64,1672.3 1141.57,1672.39 1143.49,1680.86 1145.41,1697.71 1147.33,1718.74 
1149.26,1738.64 1151.18,1757.12 1153.1,1766.35 1155.02,1742.92 1156.95,1719.5 
1158.87,1701.24 1160.79,1682.98 1162.72,1701.51 1164.64,1730.41 
1166.56,1748.49 1168.48,1758.09 1170.41,1773.28 1172.33,1799.21 
1174.25,1815.77 1176.18,1767.33 1178.1,1718.89 1180.02,1693.17 1181.94,1669.7 
1183.87,1667.95 1185.79,1675.7 1187.71,1683.6 1189.63,1691.66 1191.56,1698.56 
1193.48,1702.35 1195.4,1704.99 1197.33,1689.07 1199.25,1673.15 1201.17,1666.84 
1203.09,1662.25 1205.02,1666.51 1206.94,1675.77 1208.86,1681.63 
1210.79,1683.01 1212.71,1684.37 1214.63,1685.64 1216.55,1686.87 
1218.48,1686.31 1220.4,1685.74 1222.32,1697.24 1224.24,1711.52 1226.17,1726.65 
1228.09,1742.32 1230.01,1749.59 1231.94,1744.59 1233.86,1747.25 
1235.78,1779.76 1237.7,1812.21 1239.63,1828.84 1241.55,1845.48 1243.47,1873.16 
1245.4,1903.51 1247.32,1944.44 1249.24,1992.21 1251.16,2034.96 1253.09,2070.45 
1255.01,2106.73 1256.93,2145.88 1258.85,2185.03 1260.78,2223.62 1262.7,2262.21 
1264.62,2273.14 1266.55,2278.16 1268.47,2284.35 1270.39,2291.24 
1272.31,2300.68 1274.24,2313.39 1276.16,2331.88 1278.08,2367.77 
1280.01,2404.01 1281.93,2445.56 1283.85,2487.12 1285.77,2621.29 1287.7,2769.18 
1289.62,3014.43 1291.54,3304.77 1293.46,3552.9 1295.39,3758.31 1297.31,3846.59 
1299.23,3675.78 1301.16,3503.52 1303.08,3321.2 1305,3138.89 1306.92,3026.37 
1308.85,2917.97 1310.77,2789.32 1312.69,2654.33 1314.62,2564.24 
1316.54,2506.48 1318.46,2447.36 1320.38,2386.23 1322.31,2328.9 1324.23,2284.85 
1326.15,2240.19 1328.07,2181.9 1330,2123.62 1331.92,2093.14 1333.84,2066.91 
1335.77,2057.95 1337.69,2056.68 1339.61,2055.77 1341.53,2055.19 
1343.46,2054.38 1345.38,2053.11 1347.3,2049.68 1349.23,2035.81 1351.15,2021.94 
1353.07,2014.91 1354.99,2007.89 1356.92,2010.21 1358.84,2014.45 
1360.76,2025.16 1362.68,2039.18 1364.61,2047.63 1366.53,2050.32 
1368.45,2052.34 1370.38,2052.94 1372.3,2047.9 1374.22,2013.13 1376.14,1978.35 
1378.07,1975.97 1379.99,1973.79 1381.91,1976.65 1383.84,1980.53 
1385.76,1982.67 1387.68,1983.93 1389.6,1979.34 1391.53,1969.04 1393.45,1963.07 
1395.37,1965.35 1397.3,1971.55 1399.22,1995.02 1401.14,2019.29 1403.06,2072.8 
1404.99,2126.31 1406.91,2120.66 1408.83,2106.09 1410.75,2114.77 
1412.68,2132.86 1414.6,2198.08 1416.52,2300.91 1418.45,2403.09 1420.37,2504.31 
1422.29,2641.77 1424.21,2889 1426.14,3160.46 1428.06,3658.1 1429.98,4155.74 
1431.91,4631.09 1433.83,5105.14 1435.75,5315.98 1437.67,5458.88 1439.6,5357.1 
1441.52,5120.81 1443.44,4913.22 1445.36,4734.57 1447.29,4596.14 
1449.21,4532.29 1451.13,4468.78 1453.06,4406.59 1454.98,4342.72 1456.9,4252.07 
1458.82,4161.42 1460.75,4012.94 1462.67,3859.13 1464.59,3698.67 
1466.52,3536.25 1468.44,3364.93 1470.36,3188.38 1472.28,3041.28 
1474.21,2924.85 1476.13,2822.37 1478.05,2745.79 1479.97,2671.66 1481.9,2606.73 
1483.82,2543.15 1485.74,2496.83 1487.67,2450.51 1489.59,2430.48 
1491.51,2412.25 1493.43,2386.27 1495.36,2358.37 1497.28,2351.16 1499.2,2354.3 
1501.13,2347.7 1503.05,2332.56 1504.97,2319.08 1506.89,2308.08 1508.82,2295.78 
1510.74,2279.99 1512.66,2269.99 1514.58,2296.03 1516.51,2321.79 
1518.43,2314.35 1520.35,2306.92 1522.28,2321.32 1524.2,2338.67 1526.12,2327.12 
1528.04,2306.14 1529.97,2300.61 1531.89,2304.28 1533.81,2302.95 
1535.74,2296.65 1537.66,2299.49 1539.58,2317.34 1541.5,2329.77 1543.43,2326.35 
1545.35,2322.56 1547.27,2316.39 1549.19,2310.5 1551.12,2328.34 1553.04,2346.17 
1554.96,2348.11 1556.89,2348.13 1558.81,2335.52 1560.73,2319.21 
1562.65,2333.74 1564.58,2364.59 1566.5,2370.57 1568.42,2355.12 1570.35,2347.21 
1572.27,2349.62 1574.19,2358.64 1576.11,2382.63 1578.04,2403.82 
1579.96,2413.25 1581.88,2421.02 1583.8,2409.74 1585.73,2398.46 1587.65,2419.15 
1589.57,2440.89 1591.5,2433.41 1593.42,2421.05 1595.34,2427.46 1597.26,2440.21 
1599.19,2456.58 1601.11,2474.99 1603.03,2467.66 1604.96,2437.55 
1606.88,2425.24 1608.8,2437.14 1610.72,2446.72 1612.65,2451.33 1614.57,2461.05 
1616.49,2489.65 1618.41,2518.41 1620.34,2548.5 1622.26,2578.35 1624.18,2577.15 
1626.11,2575.95 1628.03,2583.14 1629.95,2591.2 1631.87,2620.42 1633.8,2654.76 
1635.72,2699.36 1637.64,2748.25 1639.57,2856.49 1641.49,3003.16 
1643.41,3160.34 1645.33,3327.66 1647.26,3527.8 1649.18,3774.55 1651.1,3968.78 
1653.03,4050.28 1654.95,4072.38 1656.87,3887.11 1658.79,3709.3 1660.72,3581.7 
1662.64,3457.18 1664.56,3412.7 1666.48,3368.22 1668.41,3260.13 1670.33,3148.39 
1672.25,3005.99 1674.18,2858.41 1676.1,2756.86 1678.02,2669.36 1679.94,2621.06 
1681.87,2591.41 1683.79,2582 1685.71,2586.66 1687.64,2580.41 1689.56,2563.41 
1691.48,2555.79 1693.4,2561.26 1695.33,2567.91 1697.25,2576.92 1699.17,2579.68 
1701.09,2563.71 1703.02,2552.89 1704.94,2567.67 1706.86,2577.94 
1708.79,2540.38 1710.71,2503.26 1712.63,2549.24 1714.55,2595.23 1716.48,2619.4 
1718.4,2641.83 1720.32,2610.29 1722.25,2569.01 1724.17,2565.51 1726.09,2573.31 
1728.01,2585.82 1729.94,2600.4 1731.86,2609.31 1733.78,2614.7 1735.7,2607.61 
1737.63,2590.05 1739.55,2593.16 1741.47,2619.53 1743.4,2627.4 1745.32,2607.3 
1747.24,2593.74 1749.16,2593.65 1751.09,2591.39 1753.01,2582.83 
1754.93,2575.46 1756.86,2573.22 1758.78,2574.2 1760.7,2599.05 1762.62,2622.6 
1764.55,2621.76 1766.47,2620.91 1768.39,2608.68 1770.31,2596.26 
1772.24,2581.64 1774.16,2566.84 1776.08,2576.18 1778.01,2589.63 
1779.93,2608.46 1781.85,2628.71 1783.77,2621.55 1785.7,2604.17 1787.62,2588.73 
1789.54,2574.26 1791.47,2583.67 1793.39,2608.55 1795.31,2612.49 
1797.23,2599.04 1799.16,2589.43 1801.08,2583.84 1803,2582.36 1804.92,2586.3 
1806.85,2579.07 1808.77,2553.2 1810.69,2545.74 1812.62,2577.62 1814.54,2597.82 
1816.46,2585.43 1818.38,2580.85 1820.31,2605.47 1822.23,2624.15 
1824.15,2611.21 1826.08,2598.55 1828,2588.18 1829.92,2580.41 1831.84,2616.39 
1833.77,2652.04 1835.69,2637.88 1837.61,2623.72 1839.53,2633.55 
1841.46,2644.44 1843.38,2620.44 1845.3,2592.98 1847.23,2590.43 1849.15,2591.83 
1851.07,2592.86 1852.99,2593.8 1854.92,2588.56 1856.84,2581.5 1858.76,2564.85 
1860.69,2544.64 1862.61,2532.13 1864.53,2523.13 1866.45,2524.89 
1868.38,2532.58 1870.3,2541.92 1872.22,2552.34 1874.14,2545.48 1876.07,2525.24 
1877.99,2520.52 1879.91,2529.85 1881.84,2528.4 1883.76,2515.62 1885.68,2511.49 
1887.6,2517.96 1889.53,2515.14 1891.45,2499.18 1893.37,2491.95 1895.3,2499.01 
1897.22,2505.09 1899.14,2509.29 1901.06,2511.54 1902.99,2509.47 
1904.91,2506.77 1906.83,2502.43 1908.76,2500.39 1910.68,2505.25 1912.6,2506.43 
1914.52,2494.53 1916.45,2487.89 1918.37,2503.72 1920.29,2518.24 
1922.21,2526.02 1924.14,2530.18 1926.06,2511.08 1927.98,2495.87 
1929.91,2512.82 1931.83,2528.95 1933.75,2536.02 1935.67,2542.02 1937.6,2530.5 
1939.52,2519.43 1941.44,2520.67 1943.36,2522.11 1945.29,2539.99 
1947.21,2557.88 1949.13,2558.37 1951.06,2558.71 1952.98,2560.16 1954.9,2561.64 
1956.82,2553.9 1958.75,2545.68 1960.67,2541.87 1962.59,2538.39 1964.52,2530.54 
1966.44,2522.28 1968.36,2533.43 1970.28,2546.79 1972.21,2554.46 
1974.13,2561.37 1976.05,2564.98 1977.98,2568.09 1979.9,2553.5 1981.82,2535.88 
1983.74,2537.34 1985.67,2542.41 1987.59,2548.64 1989.51,2555.11 
1991.43,2543.99 1993.36,2528.98 1995.28,2528.59 1997.2,2531.68 1999.13,2512.66 
2001.05,2488.12 2002.97,2506.81 2004.89,2536.86 2006.82,2543.85 
2008.74,2544.48 2010.66,2538.38 2012.59,2530.36 2014.51,2530.22 
2016.43,2532.37 2018.35,2527.39 2020.28,2520.25 2022.2,2522.89 2024.12,2528.51 
2026.04,2533.97 2027.97,2539.38 2029.89,2528.98 2031.81,2513.65 
2033.74,2515.08 2035.66,2521.76 2037.58,2513.56 2039.5,2500.72 2041.43,2496.33 
2043.35,2494.54 2045.27,2512.26 2047.2,2535.9 2049.12,2515.5 2051.04,2481.93 
2052.96,2486.36 2054.89,2501.89 2056.81,2495.95 2058.73,2483.94 
2060.65,2478.26 2062.58,2474.31 2064.5,2489.65 2066.42,2504.96 2068.35,2512.03 
2070.27,2515.39 2072.19,2510.94 2074.11,2501.25 2076.04,2509.97 
2077.96,2521.84 2079.88,2517.1 2081.81,2505.15 2083.73,2521.26 2085.65,2542.55 
2087.57,2563.6 2089.5,2583.59 2091.42,2574.94 2093.34,2556.87 2095.26,2558.61 
2097.19,2558.92 2099.11,2561.9 2101.03,2568.33 2102.96,2576.72 2104.88,2584.16 
2106.8,2577.47 2108.72,2561.69 2110.65,2569.15 2112.57,2584.9 2114.49,2581.79 
2116.42,2577.26 2118.34,2597.78 2120.26,2609.9 2122.18,2602.99 2124.11,2605.32 
2126.03,2615.98 2127.95,2621.1 2129.87,2612.27 2131.8,2597.87 2133.72,2594.7 
2135.64,2614.29 2137.57,2631.34 2139.49,2626.7 2141.41,2618.06 2143.33,2610.02 
2145.26,2603.52 2147.18,2602.02 2149.1,2607.21 2151.03,2616.24 2152.95,2624.33 
2154.87,2642.2 2156.79,2662.37 2158.72,2665.14 2160.64,2655.29 2162.56,2647.87 
2164.48,2652.62 2166.41,2658.09 2168.33,2655.02 2170.25,2644.89 
2172.18,2634.11 2174.1,2640.91 2176.02,2662.11 2177.94,2668 2179.87,2659.67 
2181.79,2653.17 2183.71,2652.9 2185.64,2656.47 2187.56,2661.12 2189.48,2667.99 
2191.4,2675.02 2193.33,2680.43 2195.25,2678.51 2197.17,2670 2199.09,2664.41 
2201.02,2655.62 2202.94,2653.5 2204.86,2659.92 2206.79,2660.82 2208.71,2659.34 
2210.63,2657.04 2212.55,2652.86 2214.48,2654.04 2216.4,2652.43 2218.32,2641.67 
2220.25,2631.69 2222.17,2632.43 2224.09,2629.15 2226.01,2635.67 
2227.94,2649.12 2229.86,2671.2 2231.78,2696.67 2233.71,2685.99 2235.63,2665.56 
2237.55,2669.38 2239.47,2682.17 2241.4,2678.82 2243.32,2674.53 2245.24,2692.28 
2247.16,2716.37 2249.09,2689.32 2251.01,2657.15 2252.93,2664.64 
2254.86,2686.77 2256.78,2680.34 2258.7,2672.42 2260.62,2670.16 2262.55,2668.1 
2264.47,2670.4 2266.39,2674.97 2268.32,2706.81 2270.24,2733.57 2272.16,2723.25 
2274.08,2714.26 2276.01,2712.01 2277.93,2709.56 2279.85,2706.35 
2281.77,2704.41 2283.7,2706.14 2285.62,2711.22 2287.54,2723.96 2289.47,2724.64 
2291.39,2703.24 2293.31,2692.71 2295.23,2698.39 2297.16,2698.04 
2299.08,2690.41 2301,2696.27 2302.93,2715.45 2304.85,2705.86 2306.77,2673.15 
2308.69,2674.84 2310.62,2698.72 2312.54,2702.67 2314.46,2696.45 
2316.38,2694.13 2318.31,2693.37 2320.23,2669.76 2322.15,2639.39 
2324.08,2657.84 2326,2686.42 2327.92,2686.77 2329.84,2683.47 2331.77,2696.99 
2333.69,2711.49 2335.61,2718.09 2337.54,2723.62 2339.46,2713.14 2341.38,2704.3 
2343.3,2707.1 2345.23,2708.53 2347.15,2703.88 2349.07,2701.8 2350.99,2707.51 
2352.92,2717.62 2354.84,2737.45 2356.76,2743.64 2358.69,2727.2 2360.61,2708.94 
2362.53,2688.38 2364.45,2685.24 2366.38,2698.96 2368.3,2694.75 2370.22,2677.28 
2372.15,2695.72 2374.07,2734.07 2375.99,2734.07 2377.91,2718.58 
2379.84,2719.16 2381.76,2724.22 2383.68,2722.67 2385.6,2719.97 2387.53,2712.98 
2389.45,2705.64 2391.37,2705.86 2393.3,2704.88 2395.22,2687.46 2397.14,2673.41 
2399.06,2679.43 2400.99,2687.3 2402.91,2701.68 2404.83,2712.9 2406.76,2716.56 
2408.68,2716.88 2410.6,2711.59 2412.52,2705.42 2414.45,2698.17 2416.37,2706.98 
2418.29,2730.06 2420.21,2740.61 2422.14,2743.1 2424.06,2749.71 2425.98,2758.19 
2427.91,2727.35 2429.83,2684.79 2431.75,2703.53 2433.67,2732.83 2435.6,2743.65 
2437.52,2753.03 2439.44,2752.86 2441.37,2751.68 2443.29,2741.87 
2445.21,2732.93 2447.13,2727.67 2449.06,2719.37 2450.98,2703.16 2452.9,2696.95 
2454.82,2708.1 2456.75,2724.59 2458.67,2747.52 2460.59,2751.27 2462.52,2738.87 
2464.44,2734.28 2466.36,2734.22 2468.28,2718.07 2470.21,2695.77 
2472.13,2705.17 2474.05,2721.74 2475.98,2729.36 2477.9,2736.07 2479.82,2737.78 
2481.74,2739.62 2483.67,2742.71 2485.59,2745.42 2487.51,2746.53 
2489.44,2750.59 2491.36,2761.87 2493.28,2764.96 2495.2,2755 2497.13,2745.16 
2499.05,2735.45 2500.97,2742.23 2502.89,2760.79 2504.82,2770.31 
2506.74,2775.63 2508.66,2777.85 2510.59,2779.21 2512.51,2778.31 
2514.43,2777.13 2516.35,2780.43 2518.28,2783.3 2520.2,2781.22 2522.12,2782.41 
2524.05,2797.09 2525.97,2803.52 2527.89,2790.71 2529.81,2782.49 
2531.74,2780.99 2533.66,2781.3 2535.58,2783.32 2537.5,2785.06 2539.43,2786.63 
2541.35,2798.1 2543.27,2813.25 2545.2,2808.69 2547.12,2800.33 2549.04,2813.37 
2550.96,2828.3 2552.89,2854.57 2554.81,2870.86 2556.73,2838.92 2558.66,2817.84 
2560.58,2824.06 2562.5,2832.12 2564.42,2842.96 2566.35,2855.01 2568.27,2868.21 
2570.19,2875.13 2572.11,2878.33 2574.04,2867.68 2575.96,2852.28 
2577.88,2859.64 2579.81,2870.65 2581.73,2849.46 2583.65,2832.83 
2585.57,2864.05 2587.5,2888.24 2589.42,2887.22 2591.34,2888.74 2593.27,2895.22 
2595.19,2899.42 2597.11,2900.95 2599.03,2888.9 2600.96,2867.11 2602.88,2865.8 
2604.8,2873.04 2606.72,2878.92 2608.65,2884.52 2610.57,2897.85 2612.49,2907.75 
2614.42,2873.94 2616.34,2852.8 2618.26,2880.25 2620.18,2902.29 2622.11,2913.58 
2624.03,2913.23 2625.95,2899.34 2627.88,2889.25 2629.8,2881.78 2631.72,2873.45 
2633.64,2864.77 2635.57,2888.31 2637.49,2917.4 2639.41,2903.8 2641.33,2891.09 
2643.26,2890.07 2645.18,2898.42 2647.1,2934.79 2649.03,2947.62 2650.95,2922.81 
2652.87,2918.83 2654.79,2934.11 2656.72,2923.03 2658.64,2898.1 2660.56,2900.64 
2662.49,2910.4 2664.41,2903.93 2666.33,2899.2 2668.25,2934.99 2670.18,2964.73 
2672.1,2971.36 2674.02,2973.43 2675.94,2966.95 2677.87,2979.29 2679.79,3011.34 
2681.71,3020.32 2683.64,3015.78 2685.56,3009.31 2687.48,3002.27 2689.4,2991.68 
2691.33,2981.95 2693.25,2990.37 2695.17,3000.88 2697.1,3019.49 2699.02,3041.38 
2700.94,3069.3 2702.86,3094.73 2704.79,3117.67 2706.71,3132.74 2708.63,3143.54 
2710.55,3153.49 2712.48,3163.21 2714.4,3197.65 2716.32,3231 2718.25,3240.53 
2720.17,3255.77 2722.09,3288.36 2724.01,3307.16 2725.94,3305.14 
2727.86,3318.63 2729.78,3344.7 2731.71,3313.04 2733.63,3257.25 2735.55,3234.38 
2737.47,3216.7 2739.4,3186.96 2741.32,3157.15 2743.24,3127 2745.17,3093.28 
2747.09,3052.23 2749.01,3020.27 2750.93,2997.89 2752.86,2999.65 
2754.78,3014.72 2756.7,3008.72 2758.62,2997.6 2760.55,2992.27 2762.47,2991.45 
2764.39,3020.56 2766.32,3032.05 2768.24,2999.91 2770.16,3004.21 
2772.08,3052.99 2774.01,3038.86 2775.93,2985.3 2777.85,2993.95 2779.78,3020.26 
2781.7,3031.49 2783.62,3039.51 2785.54,3028.93 2787.47,3017.6 2789.39,3004.33 
2791.31,3001.65 2793.23,3012.12 2795.16,3009.68 2797.08,2999.11 2799,3060.18 
2800.93,3141.03 2802.85,3121.91 2804.77,3103.85 2806.69,3126.98 
2808.62,3150.36 2810.54,3174.36 2812.46,3189.39 2814.39,3194.29 
2816.31,3217.07 2818.23,3249.75 2820.15,3297.29 2822.08,3348.15 2824,3417.62 
2825.92,3493.36 2827.84,3599.27 2829.77,3729.51 2831.69,3905.83 
2833.61,4109.44 2835.54,4337.92 2837.46,4723.11 2839.38,5174.72 2841.3,5823.59 
2843.23,6509.6 2845.15,7358.11 2847.07,8171.41 2849,8874.83 2850.92,9347.87 
2852.84,9508.01 2854.76,9429.33 2856.69,9196.07 2858.61,8886.18 
2860.53,8556.03 2862.45,8287.17 2864.38,8028.71 2866.3,7816.56 2868.22,7657.21 
2870.15,7597.77 2872.07,7613.26 2873.99,7694.48 2875.91,7869.36 
2877.84,8080.63 2879.76,8382.44 2881.68,8693.8 2883.61,9009.14 2885.53,9223.73 
2887.45,9188.62 2889.37,9015.38 2891.3,8691.39 2893.22,8495.32 2895.14,8362.42 
2897.06,8252.9 2898.99,8150.66 2900.91,8108.85 2902.83,8048.88 2904.76,7934.41 
2906.68,7804.9 2908.6,7656.59 2910.52,7482.44 2912.45,7293.79 2914.37,7177.94 
2916.29,7076.95 2918.22,6993.12 2920.14,6916.43 2922.06,6863.41 
2923.98,6826.95 2925.91,6812.32 2927.83,6778.72 2929.75,6733.98 
2931.67,6655.82 2933.6,6569.65 2935.52,6447.09 2937.44,6308.97 2939.37,6120.17 
2941.29,5871.75 2943.21,5546.76 2945.13,5251.49 2947.06,4972.83 
2948.98,4704.79 2950.9,4448.57 2952.83,4373.7 2954.75,4307.39 2956.67,4265.79 
2958.59,4205.72 2960.52,4124.3 2962.44,4044.75 2964.36,3966.1 2966.28,3865.95 
2968.21,3765.32 2970.13,3689.15 2972.05,3619.27 2973.98,3564.01 2975.9,3496.64 
2977.82,3417.73 2979.74,3372.86 2981.67,3340.99 2983.59,3335.92 
2985.51,3328.45 2987.44,3297.07 2989.36,3271.97 2991.28,3257.89 2993.2,3265.14 
2995.13,3287.92 2997.05,3321.51 2998.97,3358.36 3000.9,3438.15 3002.82,3503.17 
3004.74,3518.23 3006.66,3529.09 3008.59,3534.77 3010.51,3511.29 
3012.43,3473.17 3014.35,3425.9 3016.28,3371.68 3018.2,3268.64 3020.12,3195.82 
3022.05,3184.99 3023.97,3140.41 3025.89,3068.12 3027.81,3035.24 
3029.74,3013.98 3031.66,3006.43 3033.58,2988.79 3035.51,2935.43 
3037.43,2916.16 3039.35,2939.12 3041.27,2939.68 3043.2,2929.33 3045.12,2928.17 
3047.04,2929.08 3048.96,2937.18 3050.89,2931.75 3052.81,2901.78 
3054.73,2870.84 3056.66,2839.21 3058.58,2862.87 3060.5,2896.82 3062.42,2884.43 
3064.35,2878.95 3066.27,2891.45 3068.19,2883.95 3070.12,2857.22 
3072.04,2864.31 3073.96,2883.1 3075.88,2899.75 3077.81,2909.24 3079.73,2892.31 
3081.65,2870.46 3083.57,2842.55 3085.5,2832.9 3087.42,2831.72 3089.34,2802.53 
3091.27,2779.24 3093.19,2799.78 3095.11,2812.6 3097.03,2813.77 3098.96,2804.54 
3100.88,2789.4 3102.8,2789.23 3104.73,2791.17 3106.65,2793.32 3108.57,2793.12 
3110.49,2788.79 3112.42,2776.39 3114.34,2758.7 3116.26,2753.36 3118.18,2749.48 
3120.11,2737.79 3122.03,2728.84 3123.95,2725.32 3125.88,2724.45 3127.8,2725.48 
3129.72,2729.59 3131.64,2732.85 3133.57,2717.95 3135.49,2713.23 
3137.41,2729.77 3139.34,2732.77 3141.26,2725.67 3143.18,2741.57 3145.1,2761.53 
3147.03,2769.95 3148.95,2766.09 3150.87,2736.63 3152.79,2729.52 
3154.72,2738.87 3156.64,2719.74 3158.56,2697.7 3160.49,2709 3162.41,2719.98 
3164.33,2730.31 3166.25,2748.21 3168.18,2771.34 3170.1,2776 3172.02,2776.1 
3173.95,2765.72 3175.87,2759.15 3177.79,2759.32 3179.71,2744.22 
3181.64,2719.75 3183.56,2730.85 3185.48,2741.73 3187.4,2720.81 3189.33,2708.85 
3191.25,2710.37 3193.17,2712.32 3195.1,2714.48 3197.02,2704.96 3198.94,2698.56 
3200.86,2710.21 3202.79,2712.94 3204.71,2704.7 3206.63,2708.99 3208.56,2718.31 
3210.48,2710.48 3212.4,2703.03 3214.32,2697.95 3216.25,2695.59 3218.17,2695.82 
3220.09,2706.43 3222.01,2718.88 3223.94,2708.26 3225.86,2704.73 
3227.78,2716.54 3229.71,2717.08 3231.63,2709.63 3233.55,2695.8 3235.47,2683.01 
3237.4,2684.79 3239.32,2687.2 3241.24,2690.57 3243.17,2680.79 3245.09,2664.6 
3247.01,2680.67 3248.93,2693.47 3250.86,2688.15 3252.78,2691.74 3254.7,2704.42 
3256.63,2692.64 3258.55,2675.15 3260.47,2689.43 3262.39,2697.68 
3264.32,2693.39 3266.24,2714.4 3268.16,2752.07 3270.08,2737.29 3272.01,2720.67 
3273.93,2731.09 3275.85,2730.56 3277.78,2716.17 3279.7,2741.4 3281.62,2781.57 
3283.54,2771.31 3285.47,2763.05 3287.39,2759.72 3289.31,2780.17 
3291.24,2818.52 3293.16,2829.88 3295.08,2834.29 3297,2824.01 3298.93,2814.55 
3300.85,2806.19 3302.77,2825.18 3304.69,2855.22 3306.62,2845.72 
3308.54,2851.33 3310.46,2894.53 3312.39,2895.94 3314.31,2866.51 
3316.23,2916.05 3318.15,2971.27 3320.08,2990.56 3322,3012.99 3323.92,3039.32 
3325.85,3026.93 3327.77,3002.11 3329.69,3018.72 3331.61,3011.06 
3333.54,2952.61 3335.46,2911.75 3337.38,2881.79 3339.3,2888.32 3341.23,2881.39 
3343.15,2809.82 3345.07,2780.64 3347,2793.13 3348.92,2764.43 3350.84,2732.17 
3352.76,2760.61 3354.69,2756.45 3356.61,2702.82 3358.53,2690.38 
3360.46,2695.91 3362.38,2661.52 3364.3,2649.11 3366.22,2689.09 3368.15,2695.6 
3370.07,2679.65 3371.99,2679.97 3373.91,2686.9 3375.84,2712.73 3377.76,2722.63 
3379.68,2717.06 3381.61,2697.24 3383.53,2679.73 3385.45,2704.75 
3387.37,2717.93 3389.3,2714.96 3391.22,2703.09 3393.14,2687.95 3395.07,2673.87 
3396.99,2656.66 3398.91,2633.52 3400.83,2626.97 3402.76,2629.22 
3404.68,2645.37 3406.6,2651.68 3408.52,2630.55 3410.45,2622.01 3412.37,2622.4 
3414.29,2636.23 3416.22,2640.88 3418.14,2605.07 3420.06,2587.3 3421.98,2585.96 
3423.91,2596.51 3425.83,2605.81 3427.75,2595.15 3429.68,2588 3431.6,2584.84 
3433.52,2565.43 3435.44,2548.61 3437.37,2595.42 3439.29,2621.64 
3441.21,2619.23 3443.13,2588.1 3445.06,2549.64 3446.98,2560.6 3448.9,2569.36 
3450.83,2574.46 3452.75,2574.65 3454.67,2572.86 3456.59,2579.45 
3458.52,2583.84 3460.44,2583.94 3462.36,2574.36 3464.29,2559.85 
3466.21,2544.12 3468.13,2538.91 3470.05,2557.08 3471.98,2567.64 3473.9,2573.85 
3475.82,2558.84 3477.74,2553.39 3479.67,2573.63 3481.59,2574.29 3483.51,2562.7 
3485.44,2550.71 3487.36,2542.18 3489.28,2542.98 3491.2,2528.21 3493.13,2503.13 
3495.05,2526.5 3496.97,2550.36 3498.9,2565.64 3500.82,2561.32 3502.74,2543.65 
3504.66,2507.88 3506.59,2491.02 3508.51,2532.17 3510.43,2543.07 
3512.35,2533.29 3514.28,2519.15 3516.2,2512.1 3518.12,2525.78 3520.05,2535.09 
3521.97,2541.48 3523.89,2547.12 3525.81,2547.45 3527.74,2533.83 
3529.66,2534.25 3531.58,2543.56 3533.51,2504.29 3535.43,2488.91 
3537.35,2538.01 3539.27,2538.64 3541.2,2510.88 3543.12,2514.05 3545.04,2521.62 
3546.97,2536.83 3548.89,2525.52 3550.81,2500.3 3552.73,2521.4 3554.66,2523.01 
3556.58,2487.18 3558.5,2482.61 3560.42,2492.17 3562.35,2499.93 3564.27,2501.03 
3566.19,2491.22 3568.12,2496.99 3570.04,2507.77 3571.96,2507.74 
3573.88,2495.93 3575.81,2467.98 3577.73,2482.89 3579.65,2502.46 
3581.57,2462.78 3583.5,2462.52 3585.42,2506.61 3587.34,2505.98 3589.27,2496.16 
3591.19,2488.89 3593.11,2490.08 3595.03,2498.89 3596.96,2476.49 
3598.88,2459.36 3600.8,2473.51 3602.73,2476.57 3604.65,2471.88 3606.57,2478.23 
3608.49,2482.94 3610.42,2482.31 3612.34,2487.29 3614.26,2495.06 3616.19,2493.7 
3618.11,2482.73 3620.03,2455.6 3621.95,2458.45 3623.88,2469.94 3625.8,2458.21 
3627.72,2444.4 3629.64,2428.07 3631.57,2436.18 3633.49,2448.71 3635.41,2455.52 
3637.34,2461.77 3639.26,2467.54 3641.18,2474.44 3643.1,2471.68 3645.03,2441.63 
3646.95,2431.26 3648.87,2432.52 3650.8,2447.8 3652.72,2460.75 3654.64,2469.41 
3656.56,2450.76 3658.49,2424.93 3660.41,2428.85 3662.33,2426.33 
3664.25,2416.34 3666.18,2389.98 3668.1,2371.86 3670.02,2399.93 3671.95,2405.26 
3673.87,2393.54 3675.79,2409.29 3677.71,2419.23 3679.64,2412.78 
3681.56,2412.93 3683.48,2415.92 3685.41,2416.22 3687.33,2415.27 
3689.25,2412.66 3691.17,2399.61 3693.1,2390.98 3695.02,2413.34 3696.94,2407.68 
3698.86,2379.84 3700.79,2376.96 3702.71,2375.66 3704.63,2374.02 
3706.56,2371.75 3708.48,2370.27 3710.4,2383.69 3712.32,2381.77 3714.25,2360.95 
3716.17,2361.89 3718.09,2363.71 3720.02,2351.76 3721.94,2347.19 
3723.86,2347.72 3725.78,2366.4 3727.71,2383.98 3729.63,2398.63 3731.55,2391.16 
3733.47,2378.08 3735.4,2380.51 3737.32,2374.81 3739.24,2361.26 3741.17,2372.03 
3743.09,2377.78 3745.01,2363.3 3746.93,2370.39 3748.86,2386.18 3750.78,2367.17 
3752.7,2367.2 3754.63,2391.09 3756.55,2371.57 3758.47,2349.72 3760.39,2350.07 
3762.32,2347.79 3764.24,2343.87 3766.16,2340.27 3768.08,2329.51 
3770.01,2307.84 3771.93,2307.01 3773.85,2313.32 3775.78,2326.63 3777.7,2343.31 
3779.62,2362.46 3781.54,2342.15 3783.47,2331.78 3785.39,2340.64 
3787.31,2334.03 3789.24,2319.84 3791.16,2291.11 3793.08,2289.21 3795,2308.68 
3796.93,2305.03 3798.85,2310.85 3800.77,2335.97 3802.7,2322.02 3804.62,2302.74 
3806.54,2324.76 3808.46,2318.65 3810.39,2289.87 3812.31,2314.34 
3814.23,2327.29 3816.15,2315.03 3818.08,2302.69 3820,2294.52 
##MOLFORM=C18 H37 N
##RESOLUTION=2
##PRESSURE=100
##TEMPERATURE=26.85
##END=
