BSCH20 -OEChem-04022118143D 55 59 0 0 0 0 0 0 0999 V2000 -4.7400 -0.8983 1.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2921 -4.0922 -0.0042 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1799 -0.0777 -0.0923 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6498 1.7404 -0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5301 -0.8124 -0.0989 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0333 1.3852 -0.1275 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1466 3.6314 -0.1748 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5149 4.4954 0.8768 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9991 4.2738 0.8799 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9267 2.1558 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 0.4033 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6816 0.3128 1.0385 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4981 -0.3522 -1.3694 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8421 -0.6729 1.1852 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6654 -1.3245 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5529 -0.5010 -0.0832 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8427 0.0546 -0.0975 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -0.1258 -0.3973 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3657 -1.8938 -0.0516 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9270 -0.8192 -0.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7947 -0.1768 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4672 -2.7437 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7785 0.6185 -1.5744 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7492 -2.2054 -0.0482 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9641 0.5167 0.1563 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9479 1.3120 -1.8862 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0408 1.2612 -1.0209 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9050 -0.8921 2.4456 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9482 -4.5730 0.0088 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2141 4.0699 -1.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9389 4.0316 1.6687 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1517 5.4711 0.5768 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6327 5.1007 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4109 3.6628 1.6742 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0642 1.3270 0.8685 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 0.3232 1.9722 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2032 -0.7998 -2.0843 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8317 0.5976 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4902 -0.3229 1.9934 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4575 -1.6541 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2707 -2.3009 -0.8543 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2048 -1.5034 -2.1023 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -2.2746 -0.0353 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9408 -0.4233 -0.0902 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9573 0.6928 -2.2781 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6188 -2.8570 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8524 0.5247 0.7782 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 1.8924 -2.8023 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9507 1.8018 -1.2648 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6847 -1.5149 3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7609 -1.3500 1.9381 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1291 0.1120 2.8215 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9971 -5.6666 0.0312 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4123 -4.2964 -0.9056 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4169 -4.2591 0.9139 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 28 1 0 0 0 0 2 22 1 0 0 0 0 2 29 1 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 10 1 0 0 0 0 4 11 2 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 18 1 0 0 0 0 6 10 2 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 11 16 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 15 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 18 23 2 0 0 0 0 19 22 2 0 0 0 0 19 43 1 0 0 0 0 20 24 2 0 0 0 0 20 44 1 0 0 0 0 21 25 2 0 0 0 0 22 24 1 0 0 0 0 23 26 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 27 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END $$$$