L21NUM -OEChem-05022322433D 37 37 0 1 0 0 0 0 0999 V2000 2.2045 0.8053 0.7272 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1073 1.5647 0.8168 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9237 -1.0578 1.7049 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5599 3.3833 -0.4951 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9746 -0.1654 -0.4359 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6501 -0.8494 0.1159 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5523 -1.4069 -0.7772 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2453 -1.5960 -0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -0.6898 -0.6303 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8473 -2.1846 -0.9046 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9655 0.0809 0.2365 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1583 -2.4116 -0.1536 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7146 -1.1571 0.4988 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5319 1.1129 -0.0631 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4598 2.1418 0.2704 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5319 2.4298 -0.9036 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7938 -1.5034 0.9845 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3838 -0.7532 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -2.3763 -1.1783 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -0.6425 0.3947 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4135 -2.2649 0.8463 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8301 -0.1713 -1.5882 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3916 -1.6750 -0.8756 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5081 -3.1457 -1.3103 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0075 -1.5234 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2774 -0.5145 1.1008 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8591 0.3580 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9161 -2.8073 -0.8398 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0102 -3.1622 0.6317 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1949 0.9783 0.7985 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1427 1.4576 -0.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8033 -0.3384 -1.4216 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9351 3.0762 0.5932 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8608 1.8004 1.1244 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0055 1.5272 -1.2286 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0908 2.8411 -1.7502 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0166 3.5486 -1.2606 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 2 11 1 0 0 0 0 3 13 2 0 0 0 0 4 16 1 0 0 0 0 4 37 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 M END $$$$