B4TC0A -OEChem-04022110493D 54 56 0 0 0 0 0 0 0999 V2000 -7.8644 0.5127 1.3135 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7826 1.2969 -0.3566 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7520 -0.7272 0.3304 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5920 1.1210 -1.0058 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8694 0.0417 0.1729 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7144 0.3212 0.1053 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6826 -1.4529 -0.0227 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1622 -1.5584 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2336 -1.4041 -1.4177 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1152 -0.1799 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5067 0.9284 -0.8122 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7351 -1.1109 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8546 1.4311 -0.2967 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0916 -0.6541 1.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5632 -0.4062 -0.3089 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7345 0.2035 0.3481 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 0.6893 -0.1088 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8561 0.2434 -0.5818 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9234 -0.5946 -0.4587 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2207 1.3681 0.9184 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0648 0.3042 -0.2528 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0846 0.9363 -0.1242 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5984 -0.2283 -0.6949 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8956 1.7345 0.6823 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1467 -0.8139 0.0162 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7426 -2.0018 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1882 -2.3665 0.2941 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7999 -0.7178 -0.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6272 -2.5256 -0.1004 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0730 -2.2664 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2374 -0.4559 -1.9413 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8867 1.8066 -1.0182 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6566 0.4019 -1.7644 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8841 -1.7166 -0.4399 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2679 -1.7540 1.2195 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3451 2.0384 -1.0643 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7158 2.0682 0.5855 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9738 -0.1646 1.9772 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7376 -1.5245 1.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6044 -0.7275 -1.3576 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2318 -1.2775 0.2717 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 0.9731 0.9504 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7842 1.6061 -0.6481 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1274 -0.6603 -0.0206 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8289 0.0124 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 -1.5049 -0.9261 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8327 2.0061 1.5505 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0089 -0.8621 -1.3508 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5003 2.6426 1.1293 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2696 -0.9405 -1.0652 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6503 0.1052 0.3356 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6106 -1.8986 1.8231 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2361 -2.9268 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8098 -2.0982 0.5229 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 18 1 0 0 0 0 2 22 1 0 0 0 0 3 21 1 0 0 0 0 3 25 1 0 0 0 0 4 21 2 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 15 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 16 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 23 1 0 0 0 0 19 46 1 0 0 0 0 20 24 2 0 0 0 0 20 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 M END $$$$