BH1NI5 -OEChem-04022103153D 43 46 0 1 0 0 0 0 0999 V2000 -2.2130 -2.0044 0.4928 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3831 2.7250 -0.6406 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6037 -0.3208 0.0408 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8783 -0.4525 -0.2524 N 0 0 1 0 0 0 0 0 0 0 0 0 0.4464 1.3439 -0.3121 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2446 -0.9663 0.2365 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1583 0.3307 -0.0335 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1935 1.3840 -0.2816 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5918 0.9283 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5357 -0.9656 0.2552 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -1.4202 0.3865 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7374 0.4554 -0.0798 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0975 -0.7425 0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2673 -0.8093 0.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 1.6221 -0.3696 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9787 0.0824 -0.0106 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4607 -0.0235 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2359 1.0792 0.3628 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0767 -1.2260 -0.3423 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6271 0.9795 0.3752 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -1.3258 -0.3301 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2431 -0.2231 0.0289 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4402 2.1706 0.7624 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1088 -2.6213 -0.7051 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 2.3109 0.2389 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2196 1.6006 -1.3569 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6619 1.0035 1.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3300 1.6227 -0.2348 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -2.3987 -0.0936 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1925 -1.5330 1.4534 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9529 -0.1364 -0.4932 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4945 -0.7635 1.1048 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4855 -1.8220 -0.3231 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0688 2.1158 -0.5309 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7739 2.0159 0.6627 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4771 -2.0864 -0.6297 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8136 3.0395 0.9904 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1107 2.4556 -0.0552 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0353 1.9503 1.6548 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3633 -3.3832 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6988 -3.0161 0.1288 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 -2.4951 -1.5838 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8967 -1.2075 -0.2195 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 13 1 0 0 0 0 2 15 2 0 0 0 0 3 22 1 0 0 0 0 3 43 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 5 34 1 0 0 0 0 6 13 1 0 0 0 0 6 16 2 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 35 1 0 0 0 0 19 21 2 0 0 0 0 19 36 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END $$$$