BAI6T2 -OEChem-04022103463D 51 54 0 1 0 0 0 0 0999 V2000 -3.8990 1.0287 0.5293 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0092 2.1563 -0.1587 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -0.5949 -0.9871 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4761 -1.2833 0.9096 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9434 0.1669 -0.3383 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9029 -0.0345 -0.2463 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0225 -0.1768 0.0915 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9182 -2.8817 0.2134 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4831 -0.1801 -0.7565 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.4056 -1.3603 -0.5328 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3028 0.6963 0.4805 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2303 0.1643 -0.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8192 -0.9262 -0.2342 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7198 -0.1559 -0.9314 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3105 1.1290 0.5545 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1859 1.1167 0.4159 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7229 -0.7248 0.8577 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8281 2.1291 -0.2971 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9325 0.0932 0.9998 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9636 1.0947 0.1579 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2169 2.1181 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3213 0.0823 0.8707 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4117 1.0833 0.0244 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3969 -0.4981 -0.0287 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8339 -1.8214 0.0311 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3184 0.5332 -0.2099 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1926 -2.1133 -0.0901 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6771 0.2413 -0.3314 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1140 -1.0820 -0.2715 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8170 0.4331 -1.6022 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0297 -1.9949 0.2807 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4209 -1.9940 -1.4289 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 1.6193 0.4134 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5552 0.1869 1.4169 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8756 -1.2721 -1.6976 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1097 -1.8547 1.6594 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5790 0.3180 -1.8921 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5556 0.9061 1.6022 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6743 2.1457 0.3523 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4453 -0.8584 1.6502 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 2.9308 -0.7603 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4427 -0.6960 1.5643 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6963 2.9136 -0.9905 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8604 -0.7129 1.3769 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4176 -0.9843 0.1807 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0678 1.5823 -0.2612 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5472 -3.1399 -0.0453 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3962 1.0434 -0.4713 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1719 -1.3091 -0.3657 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2644 -3.8317 0.2555 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9298 -2.7187 0.3311 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 23 2 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 3 35 1 0 0 0 0 4 13 1 0 0 0 0 4 17 1 0 0 0 0 4 36 1 0 0 0 0 5 12 2 0 0 0 0 5 15 1 0 0 0 0 6 14 1 0 0 0 0 6 17 2 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 7 45 1 0 0 0 0 8 25 1 0 0 0 0 8 50 1 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 10 13 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 13 14 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 40 1 0 0 0 0 18 21 1 0 0 0 0 18 41 1 0 0 0 0 19 22 2 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 27 2 0 0 0 0 26 28 1 0 0 0 0 26 46 1 0 0 0 0 27 29 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M END $$$$