BA2S6Z -OEChem-04042102023D 39 40 0 0 0 0 0 0 0999 V2000 3.6963 2.5049 0.0121 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2779 0.2408 -0.0905 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9908 -1.5774 0.7935 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3642 -2.3325 -0.1476 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3144 0.4462 -0.3309 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3003 -0.2263 0.0952 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1408 -0.1080 0.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0791 -0.4546 0.1877 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0588 0.7461 0.7472 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9314 -1.3129 -0.5104 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9336 -1.2542 -0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 1.1530 0.0526 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4481 0.6320 0.7934 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3208 -1.4271 -0.4641 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3231 -1.1398 -0.0512 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1267 1.2675 0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9195 0.1211 -0.0461 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5274 -0.5735 0.2357 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7698 0.4055 -0.3084 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7241 1.6147 -0.9802 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1321 -2.3498 -0.1037 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8138 3.6242 0.0664 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6116 1.5885 1.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -2.0773 -1.0569 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4981 -2.2501 0.0229 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0974 2.0269 0.0503 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 1.3843 1.3305 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8017 -2.2736 -0.9477 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1392 0.3665 -1.3371 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1293 -0.4732 0.2329 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1410 1.3082 0.1852 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6512 2.4220 -0.2461 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7429 1.4032 -1.4092 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3754 1.9384 -1.7986 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5903 -3.3109 -0.1035 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 -0.6241 -0.1331 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4378 4.5241 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2305 3.6366 0.9936 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 3.6863 -0.8277 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 22 1 0 0 0 0 2 17 1 0 0 0 0 2 36 1 0 0 0 0 3 18 2 0 0 0 0 4 21 2 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 13 2 0 0 0 0 8 14 1 0 0 0 0 8 18 1 0 0 0 0 9 13 1 0 0 0 0 9 23 1 0 0 0 0 10 14 2 0 0 0 0 10 24 1 0 0 0 0 11 15 1 0 0 0 0 11 25 1 0 0 0 0 12 16 2 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 17 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$