BNB8R6 -OEChem-04012115213D 56 58 0 0 0 0 0 0 0999 V2000 -6.2517 -2.2104 1.8783 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5081 1.7347 -0.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2232 -0.8660 0.1198 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -2.9335 0.0752 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4324 -1.4073 -1.2655 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3106 -0.6994 -1.0502 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0489 -0.9844 -0.4226 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6825 -0.8097 -1.6371 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4989 -0.4459 -0.4264 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0444 -2.6658 -1.0431 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5300 -0.3817 0.6604 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3724 0.8103 0.1666 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7648 -1.4632 -0.7023 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3147 -2.7609 -0.6885 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4582 -1.4624 0.4938 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 -1.3805 0.1028 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0083 -3.7845 -1.1778 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -1.0160 0.9912 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1387 0.6294 1.7402 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 1.1318 1.2889 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1524 -1.0589 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9367 2.6594 0.5853 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0259 0.1974 1.8179 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1622 -1.7198 -0.0665 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5892 3.0854 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5504 2.3681 0.4451 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 4.1986 -0.7521 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8032 2.7640 -0.0237 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7767 4.5943 -1.2209 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9163 3.8769 -0.8567 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2303 -1.5044 -2.2828 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 0.0690 -2.2578 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6206 0.1678 -0.2852 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -3.6822 -0.4656 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7652 -2.1684 -0.2875 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3266 -2.0129 1.4336 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5015 -2.3546 -0.3658 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4783 -4.7397 -1.2632 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6332 -3.6863 -2.0703 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -3.8477 -0.2957 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8385 -1.5687 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6576 -0.2507 1.0799 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1848 -1.7128 0.2035 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0012 0.1400 2.7105 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2059 1.1421 1.4838 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9145 1.3941 1.8542 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0928 2.1068 1.7648 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1554 0.0216 -0.5029 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5944 3.5321 0.6825 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8008 2.2204 1.5833 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6196 0.4637 2.6887 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4758 1.5011 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3566 4.7643 -1.0446 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6919 2.2098 0.2636 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 5.4607 -1.8698 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8917 4.1857 -1.2208 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 12 1 0 0 0 0 2 22 1 0 0 0 0 3 15 1 0 0 0 0 3 24 1 0 0 0 0 4 24 2 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 6 13 2 0 0 0 0 7 13 1 0 0 0 0 7 24 1 0 0 0 0 7 48 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 12 2 0 0 0 0 9 16 1 0 0 0 0 10 14 2 0 0 0 0 10 17 1 0 0 0 0 11 15 1 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 11 33 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 21 2 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 23 2 0 0 0 0 20 47 1 0 0 0 0 21 23 1 0 0 0 0 22 25 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 52 1 0 0 0 0 27 29 2 0 0 0 0 27 53 1 0 0 0 0 28 30 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 M END $$$$