BS8AL2 -OEChem-04022114043D 54 57 0 1 0 0 0 0 0999 V2000 -5.7320 1.4183 0.8572 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0141 1.0753 0.2545 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7154 0.1659 0.0692 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6775 1.5181 -0.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8048 -0.6912 -0.9017 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8356 -1.9998 -0.7547 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3936 0.0728 -0.7483 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8231 0.9000 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8705 0.2060 -1.1282 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3137 1.0620 1.1608 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4105 0.9727 0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2887 1.6787 -0.4716 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0713 -0.1599 -0.0487 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9861 3.1694 -0.6044 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5992 -1.2684 0.6132 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8975 0.6397 -0.8385 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3999 0.3595 -0.3032 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9534 -1.5774 0.4855 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7368 -2.1418 1.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2518 0.3307 -0.9663 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7306 0.2578 0.0857 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7798 -0.7776 -0.3041 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4205 -0.9302 -0.1524 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7699 -0.8638 0.3069 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0688 0.3539 0.8742 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5505 -1.7955 -1.0892 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7449 -1.9750 0.1898 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8045 0.1919 -1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.9426 -0.3722 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6436 -0.0878 1.9129 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5501 1.6526 2.2168 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -0.6151 -1.8062 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0343 1.1478 -1.6672 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 2.1001 0.8777 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8848 0.8457 2.0717 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7057 -0.0756 0.7081 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6097 1.4586 1.5354 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1408 1.2365 -1.4642 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0963 3.6853 0.3561 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0324 3.3396 -0.9677 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6752 3.6434 -1.3125 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1362 2.2730 0.4116 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5053 1.5111 -1.3567 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3813 -2.4365 0.9954 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4361 -1.6117 2.3745 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -2.4575 0.9183 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2606 -3.0541 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8957 0.9541 -1.5798 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8344 -1.0176 -0.4031 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0092 0.6749 1.3005 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0492 -2.6268 -1.5722 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8943 -2.2447 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3841 -2.8595 0.7252 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7203 -1.7053 0.6081 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 25 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 13 1 0 0 0 0 4 12 1 0 0 0 0 4 17 1 0 0 0 0 4 42 1 0 0 0 0 5 17 2 0 0 0 0 5 26 1 0 0 0 0 6 23 1 0 0 0 0 6 26 2 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 10 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 13 15 1 0 0 0 0 13 16 2 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 16 43 1 0 0 0 0 17 21 1 0 0 0 0 18 22 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 22 2 0 0 0 0 20 48 1 0 0 0 0 21 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END $$$$