BNSZ45 -OEChem-04012115032D 83 86 0 1 0 0 0 0 0999 V2000 6.1708 1.0689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5051 1.9689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8419 -1.4520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9579 -3.0404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4011 -2.2811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7065 0.6943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7211 0.2758 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8370 -1.3125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6733 2.8894 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2744 2.8982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4145 3.8553 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8943 2.0238 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1511 4.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4477 3.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7234 2.5830 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4084 3.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7744 2.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0653 1.4646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7235 0.2060 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2852 -0.6928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2876 -0.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2803 -0.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8492 -1.6613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7284 0.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2778 -0.4835 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7162 0.4153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7138 0.4851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3987 -2.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2730 -0.3440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1521 1.3838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5195 -3.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2705 -0.2742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1497 1.4536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7089 0.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0811 -4.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4183 -4.3775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6207 -3.5008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1643 1.0351 0.0000 B 0 0 0 0 0 0 0 0 0 0 0 0 4.8933 2.0684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1945 4.6764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 5.3703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7642 4.9299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4528 4.1642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0620 3.6280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2378 2.9290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0984 2.8613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8714 3.7082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7184 3.9352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3113 1.7222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4644 1.4953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2374 2.3422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4120 0.9506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5513 1.1179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7186 1.9786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9953 0.7633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8811 -0.8637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2203 -1.3094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9929 0.8330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6691 -0.8058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4065 -1.9331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5774 -2.2186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 -1.3895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2144 -0.2802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3817 0.5805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2424 0.4132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0060 -1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1202 0.5862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7810 1.0319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4555 -1.2693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0012 -0.9012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8054 1.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6172 -0.7882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4215 2.0109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6384 -5.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8093 -5.3952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5239 -4.5662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6901 -3.8203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9755 -4.6493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1465 -4.9348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3489 -4.0580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0634 -3.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8925 -2.9435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9783 1.2516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 38 1 0 0 0 0 2 15 1 0 0 0 0 2 38 1 0 0 0 0 3 22 2 0 0 0 0 4 28 1 0 0 0 0 4 31 1 0 0 0 0 5 28 2 0 0 0 0 6 34 1 0 0 0 0 6 83 1 0 0 0 0 19 7 1 1 0 0 0 7 22 1 0 0 0 0 7 58 1 0 0 0 0 25 8 1 6 0 0 0 8 28 1 0 0 0 0 8 69 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 39 1 1 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 40 1 6 0 0 0 12 15 1 0 0 0 0 12 18 1 6 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 59 1 0 0 0 0 22 25 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 26 1 0 0 0 0 25 66 1 0 0 0 0 26 27 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 29 32 1 0 0 0 0 29 70 1 0 0 0 0 30 33 2 0 0 0 0 30 71 1 0 0 0 0 31 35 1 0 0 0 0 31 36 1 0 0 0 0 31 37 1 0 0 0 0 32 34 2 0 0 0 0 32 72 1 0 0 0 0 33 34 1 0 0 0 0 33 73 1 0 0 0 0 35 74 1 0 0 0 0 35 75 1 0 0 0 0 35 76 1 0 0 0 0 36 77 1 0 0 0 0 36 78 1 0 0 0 0 36 79 1 0 0 0 0 37 80 1 0 0 0 0 37 81 1 0 0 0 0 37 82 1 0 0 0 0 M END $$$$