LBS50E -OEChem-05032301283D 54 57 0 1 0 0 0 0 0999 V2000 -0.0382 -1.0246 0.7865 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4548 1.4703 -1.3703 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3742 0.2166 2.1875 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1098 -1.4700 -0.8582 N 0 0 3 0 0 0 0 0 0 0 0 0 -4.2195 -2.5747 0.0262 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4114 0.4621 -1.8649 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 2.5139 -0.1038 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 0.6942 -1.2975 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8085 1.7343 0.3583 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6324 1.3024 3.9057 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5598 0.7820 2.8015 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4386 0.9640 3.0071 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1481 -0.6607 1.1669 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -1.1784 0.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0634 -2.4173 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0193 -0.6852 -0.5445 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6717 0.5194 -1.2893 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0809 -1.2716 -1.9067 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8409 1.5330 -2.6507 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0526 2.5232 -1.7974 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1182 1.8886 -1.0876 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6457 0.6453 -0.3962 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6128 3.8310 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4888 -0.5101 -0.2773 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2708 -1.6193 -1.0943 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5262 -0.5236 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0902 -2.7422 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3456 -1.6466 0.7703 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1276 -2.7559 -0.0467 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7469 2.3622 4.1502 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6715 0.7164 4.8308 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2969 0.0448 3.1275 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0295 1.5514 2.1824 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0037 1.8102 2.4755 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3374 0.3508 3.4708 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4052 -3.2901 0.8834 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4276 -2.3219 1.9776 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0903 -3.4273 -0.5192 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5845 -1.0955 -2.8668 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7163 -0.4095 -1.6797 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7293 -2.1467 -2.0249 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8457 -0.3731 -1.7419 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6494 2.0590 -3.1701 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 1.0708 -3.4078 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7211 2.9730 -1.0532 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3225 3.3300 -2.4377 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6557 3.8386 0.9717 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6076 4.5532 -0.3749 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4227 4.0683 1.1398 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4702 -1.6396 -1.8296 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7261 0.3218 1.3086 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9206 -3.6063 -1.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1535 -1.6577 1.4962 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7655 -3.6303 0.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 17 2 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 4 18 1 0 0 0 0 5 15 1 0 0 0 0 5 38 1 0 0 0 0 6 17 1 0 0 0 0 6 19 1 0 0 0 0 6 42 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 7 23 1 0 0 0 0 8 21 2 0 0 0 0 8 22 1 0 0 0 0 9 22 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 22 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 25 50 1 0 0 0 0 26 28 2 0 0 0 0 26 51 1 0 0 0 0 27 29 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 M END $$$$