BQP1J4 -OEChem-04022117403D 55 57 0 0 0 0 0 0 0999 V2000 -7.1888 -3.5703 0.1913 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9826 -1.2548 -0.1755 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1672 -2.1976 -1.2487 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6735 1.4761 2.4499 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 0.2728 0.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9464 1.4183 -0.8972 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3411 4.1913 0.7263 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2087 0.1599 -0.7516 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1425 0.6864 0.6853 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8494 0.2308 -1.4544 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 0.1001 1.4691 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7037 -0.3214 -0.6045 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7551 -1.2379 -0.7686 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6643 0.9774 1.3255 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 1.1459 0.5527 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7575 2.2412 -0.2834 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5722 0.1865 0.6647 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9517 2.3303 -0.9804 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2962 3.2887 -0.4247 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7301 0.3675 -0.0746 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6229 -2.5336 -0.1233 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -0.5870 -0.0089 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2082 3.4842 -1.8937 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9659 -2.3853 0.5593 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5924 -1.9142 -0.3784 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0741 -0.1823 0.4229 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6368 -2.8366 -0.3164 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1187 -1.1047 0.4849 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -2.4317 0.1153 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9163 0.7691 -1.3296 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0129 1.7762 0.6399 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0729 0.5105 1.2361 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6388 1.2836 -1.6799 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8746 -0.2914 -2.4183 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 0.5752 2.4536 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1112 -0.9745 1.6336 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7571 -0.1442 -1.1193 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -1.4055 -0.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4433 -0.6722 1.3174 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1768 3.8893 -1.3305 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 2.8206 -0.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7648 -2.9128 -1.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9958 -3.2327 0.4412 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1192 4.4369 -1.3621 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2265 3.4362 -2.2961 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 3.4654 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4837 -3.3467 0.6171 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8412 -1.9891 1.5726 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5979 -1.6750 0.0161 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6185 3.6768 1.5611 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0687 4.8892 0.5752 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6168 -2.2490 -0.7232 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2629 0.8471 0.7184 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4524 -3.8672 -0.6087 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0976 -0.7754 0.8239 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 13 1 0 0 0 0 2 21 1 0 0 0 0 3 13 2 0 0 0 0 4 14 2 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 6 18 1 0 0 0 0 6 20 2 0 0 0 0 7 19 1 0 0 0 0 7 50 1 0 0 0 0 7 51 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 17 39 1 0 0 0 0 18 23 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 22 1 0 0 0 0 21 24 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 27 1 0 0 0 0 25 52 1 0 0 0 0 26 28 2 0 0 0 0 26 53 1 0 0 0 0 27 29 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 M END $$$$