BCA0R2 -OEChem-04022108583D 37 39 0 1 0 0 0 0 0999 V2000 -4.9370 -0.4664 -0.3050 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.9614 -0.0487 -2.2267 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1047 -1.3193 1.3228 N 0 0 3 0 0 0 0 0 0 0 0 0 0.0578 1.2569 1.3518 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9105 -0.3415 -1.0105 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1571 -1.0273 0.7458 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1656 -1.8700 0.5096 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6563 0.2719 0.7749 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9163 0.5120 0.1876 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8632 -0.7798 -0.2556 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8709 -2.0733 0.1559 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6345 -0.5400 -0.4058 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3345 -1.0752 2.7291 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1112 -1.8298 -0.4208 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4194 1.8195 0.2166 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4105 -0.4194 -1.5247 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9629 -0.1288 0.3034 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6858 2.8366 0.8103 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4635 2.5052 1.3587 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0575 0.5920 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6099 0.8824 -0.4066 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1572 1.2428 -1.6759 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7986 -2.6362 -0.1849 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8988 -2.3969 1.1347 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4794 -3.0873 0.1499 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9655 -1.8581 3.1638 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3988 -1.0675 3.2999 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.1162 2.8788 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6578 -2.6530 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3827 2.0761 -0.2166 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5563 -0.9192 -1.9734 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3244 -0.3991 1.2921 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0594 3.8533 0.8417 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1546 3.2584 1.8361 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 0.8725 -3.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4658 1.3897 0.0288 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6609 2.0304 -2.2286 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 2 5 2 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 13 1 0 0 0 0 4 8 1 0 0 0 0 4 19 2 0 0 0 0 5 12 1 0 0 0 0 6 8 2 0 0 0 0 6 11 1 0 0 0 0 7 10 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 9 12 2 0 0 0 0 9 15 1 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 14 2 0 0 0 0 11 25 1 0 0 0 0 12 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 18 2 0 0 0 0 15 30 1 0 0 0 0 16 20 1 0 0 0 0 16 31 1 0 0 0 0 17 21 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 M CHG 2 1 -1 5 1 M END $$$$