BPBJ93 -OEChem-04012112393D 57 59 0 1 0 0 0 0 0999 V2000 1.1407 4.9459 0.1083 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0909 2.2992 0.0918 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7971 -0.6113 -0.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0202 1.0429 -0.1274 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0614 0.0687 0.6936 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6929 -2.3956 0.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2437 -2.2341 1.3189 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8296 -1.3027 -0.2711 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3031 2.5259 0.4235 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8283 3.7723 -0.3208 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4425 2.6615 1.9486 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6864 3.6462 -1.8445 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8894 0.1869 -0.7087 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -0.1897 0.0414 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7169 1.0746 0.2264 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8892 2.8501 2.3898 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8535 -1.3106 0.5071 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 2.4539 -2.3969 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -1.1502 0.8389 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8505 -1.9424 0.1119 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0349 0.2882 0.3004 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3803 -0.3064 -2.0711 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6271 -2.1252 1.6752 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5013 -2.3788 0.4785 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9198 -3.6711 0.2055 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7274 -3.8720 -0.9084 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6157 -1.5367 -1.3457 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0865 -2.7896 -1.7041 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 1.6685 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8916 3.9239 -0.1029 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0596 1.7598 2.4415 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8305 3.4880 2.3295 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0688 4.5654 -2.3065 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6334 3.5900 -2.1439 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6672 3.0835 -0.1909 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5006 1.2024 -0.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2801 3.8282 2.0964 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 2.7895 3.4812 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5351 2.0723 1.9704 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4941 2.4514 -2.0441 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4754 2.4990 -3.4908 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9897 1.5048 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4372 5.1521 1.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7523 -2.5307 0.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5072 -0.6847 0.4745 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8072 0.9761 -0.0598 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6740 0.6610 1.2653 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8233 -1.3061 -2.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5546 -0.3559 -2.7897 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1401 0.3703 -2.4761 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -3.1335 1.3948 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8631 -1.1492 2.1177 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8553 -2.8609 2.4563 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6329 -4.5099 0.8307 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0757 -4.8700 -1.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8669 -0.6598 -1.9331 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7149 -2.9226 -2.5772 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 43 1 0 0 0 0 2 9 1 0 0 0 0 2 15 1 0 0 0 0 2 35 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 3 20 1 0 0 0 0 4 14 2 0 0 0 0 4 15 1 0 0 0 0 5 15 2 0 0 0 0 5 19 1 0 0 0 0 6 17 1 0 0 0 0 6 20 2 0 0 0 0 7 19 1 0 0 0 0 7 23 1 0 0 0 0 7 51 1 0 0 0 0 8 24 1 0 0 0 0 8 27 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 11 16 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 18 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 13 36 1 0 0 0 0 14 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 19 2 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 28 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 M END $$$$