BS1N7R -OEChem-04022113403D 49 52 0 1 0 0 0 0 0999 V2000 4.8127 -0.2437 2.0070 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7321 -3.1429 -2.1380 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0285 0.7762 1.8922 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4671 0.6914 0.1691 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2576 0.4536 -0.3199 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 1.4492 -2.2588 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5586 1.1142 -1.9317 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5027 3.4170 0.0519 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8925 -1.0181 1.3224 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2671 -0.4333 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7473 -0.0967 0.9137 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0029 1.1536 -1.1519 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4793 1.0447 -1.2746 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4204 2.1977 0.0351 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9159 2.1012 0.3392 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6295 1.1573 0.7892 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 0.5161 -0.7605 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6492 1.0431 -0.5142 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1942 -0.3770 -0.2813 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 -0.0055 -0.0518 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3037 -0.9483 0.9864 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6633 -1.1184 -1.3367 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4644 -0.9977 -0.6282 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9990 0.4809 1.2109 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2419 -2.4311 -1.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8826 -2.2610 1.1988 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3516 -3.0023 0.1433 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5504 -1.4661 0.0935 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1057 -0.0538 1.8505 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1522 -0.7045 1.7429 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1283 -1.2934 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3157 -0.9950 1.1718 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8953 0.6660 1.6861 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4896 0.5374 -1.9112 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2713 2.1997 -1.3102 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0099 3.1668 0.3478 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2921 2.1152 -1.0472 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0891 1.9122 1.4035 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5465 1.2958 -1.5785 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7274 1.0804 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4984 3.4021 0.2692 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0883 4.1193 0.6635 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -0.6869 -2.3294 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2460 -1.4035 -1.6108 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4183 1.2602 1.6937 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9673 -2.7051 2.1861 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0229 -4.0241 0.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1943 -2.2398 -0.3114 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3989 0.2927 2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 25 1 0 0 0 0 3 16 2 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 13 2 0 0 0 0 7 17 2 0 0 0 0 8 15 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 28 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 18 1 0 0 0 0 15 38 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 26 1 0 0 0 0 22 25 2 0 0 0 0 22 43 1 0 0 0 0 23 28 1 0 0 0 0 23 44 1 0 0 0 0 24 29 2 0 0 0 0 24 45 1 0 0 0 0 25 27 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M END $$$$