B2GSC7 -OEChem-04022108053D 64 67 0 0 0 0 0 0 0999 V2000 -2.7754 2.0866 0.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2013 -2.9876 -0.1572 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7746 0.6373 -0.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6154 0.4965 -0.1943 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 1.1200 0.9877 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6263 -0.5604 -0.7369 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5495 1.8356 -0.1128 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5604 -0.2270 -1.3465 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8515 1.4628 0.6007 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8619 -0.6691 -0.6735 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5092 1.0086 -1.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5206 1.3877 -0.0298 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9885 0.3450 0.0293 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8572 1.7590 -0.6578 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1017 1.8500 0.1231 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8357 0.9760 0.9249 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1946 0.2785 2.0788 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2537 -1.2589 1.9931 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8559 0.9483 1.1767 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9481 -0.6805 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7164 2.4941 -0.9506 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1843 0.7459 0.6528 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5354 -1.8154 0.7879 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6232 0.0545 0.4581 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0649 2.2640 -1.2227 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 1.3900 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1834 -2.1478 0.8733 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -1.9976 -0.4113 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5202 -2.6626 -0.2405 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5606 -2.5122 -1.5253 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2088 -2.8447 -1.4398 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4417 -2.7761 1.0989 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9845 2.4926 0.5569 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7846 2.4172 -1.0148 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7881 0.2914 -2.2877 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9887 -1.1286 -1.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 2.3895 0.7502 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6366 1.0378 1.5894 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6459 -1.3346 0.1723 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4269 -1.2493 -1.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6393 1.8138 -1.8236 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1009 0.1500 -1.6389 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6692 0.5602 0.6748 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1814 2.2347 0.5778 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 0.9166 -1.2562 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 2.6285 -1.3141 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1477 0.5802 2.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7016 0.5996 2.9983 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2921 -1.6136 1.9928 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8094 -1.6804 2.9044 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2985 1.5701 1.9475 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4674 -1.4085 -1.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 3.1842 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7759 0.0781 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6846 -0.0626 0.6308 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5442 2.7672 -2.0573 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8497 1.2132 -0.6312 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6967 -1.9822 1.8288 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2808 -1.7618 -0.4931 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0977 -2.6573 -2.4581 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6974 -3.2455 -2.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4859 -3.0847 0.9825 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -3.4048 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4525 -1.7162 1.3738 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 29 1 0 0 0 0 2 32 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 5 13 2 0 0 0 0 5 19 1 0 0 0 0 6 13 1 0 0 0 0 6 20 2 0 0 0 0 7 9 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 10 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 14 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 21 2 0 0 0 0 16 17 1 0 0 0 0 16 22 2 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 23 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 24 2 0 0 0 0 19 51 1 0 0 0 0 20 24 1 0 0 0 0 20 52 1 0 0 0 0 21 25 1 0 0 0 0 21 53 1 0 0 0 0 22 26 1 0 0 0 0 22 54 1 0 0 0 0 23 27 2 0 0 0 0 23 28 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 27 29 1 0 0 0 0 27 58 1 0 0 0 0 28 30 2 0 0 0 0 28 59 1 0 0 0 0 29 31 2 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 M END $$$$