BT9MD2 -OEChem-04042102323D 38 41 0 0 0 0 0 0 0999 V2000 0.4332 1.5322 -1.3826 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7098 0.4125 -0.3834 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7322 -1.3364 -0.1003 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5312 -1.5619 -0.4488 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1377 -0.1691 0.3955 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9023 1.2760 -2.4381 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1298 0.7515 -2.0784 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7249 -1.6999 1.6837 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5027 1.2340 0.5602 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8269 0.5774 0.5008 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4873 0.3054 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0701 0.9441 0.2633 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8575 2.4343 1.1757 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1819 1.7778 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1971 2.7063 1.4535 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8411 -0.3781 0.1532 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 1.0417 -1.4204 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9026 -0.4041 -0.0074 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9707 0.2587 -0.8724 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7165 -2.1021 -0.5784 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5031 -0.8499 1.2522 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2202 -0.6111 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0908 -3.3982 -1.1596 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4415 -1.4846 2.0501 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0817 -1.2564 0.4575 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1925 -0.6251 -0.2574 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5686 1.4127 1.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1128 -0.1351 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1005 3.1669 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2149 2.0247 1.3478 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 3.6413 1.9323 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4936 -0.7201 1.6289 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5803 -0.2832 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7666 -3.2587 -2.0084 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2055 -3.9349 -1.5135 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5931 -4.0231 -0.4152 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1764 -1.8483 3.0374 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1155 -1.4394 0.1836 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 17 1 0 0 0 0 2 17 1 0 0 0 0 2 19 1 0 0 0 0 3 5 1 0 0 0 0 3 20 1 0 0 0 0 4 16 1 0 0 0 0 4 20 2 0 0 0 0 5 16 2 0 0 0 0 6 7 1 0 0 0 0 6 17 2 0 0 0 0 7 19 2 0 0 0 0 8 24 2 0 0 0 0 8 25 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 10 16 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 15 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 18 19 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 20 23 1 0 0 0 0 21 24 1 0 0 0 0 21 32 1 0 0 0 0 22 25 2 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 M END $$$$