BVJ82M -OEChem-04022108092D 94 96 0 1 0 0 0 0 0999 V2000 7.2566 0.5144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2746 2.5411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 -0.2299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5387 6.1370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1851 5.5989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6173 -3.4133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2637 -3.9514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5063 -0.1493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 1.0525 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 -1.3866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5637 3.6979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2601 -1.7185 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -3.4085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6853 -6.2648 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8994 2.2093 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9209 2.0030 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9674 -0.6423 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2101 3.1598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.8485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 0.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 1.4650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2531 2.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2816 -1.9247 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6783 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9710 -2.8752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 -1.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1886 3.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6388 -3.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8959 4.4422 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2619 -2.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3282 -4.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9174 4.2360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9960 -5.3143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2066 5.3927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9280 -2.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2496 4.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9065 -2.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5743 -3.0008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2171 -1.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1957 -1.0998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5528 -2.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8635 -1.8441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5061 2.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 1.5416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7748 -1.2316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1895 3.7794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5963 3.2471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 -0.2289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 -0.7612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0036 0.9247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1058 1.0509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9813 1.0035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0287 1.8790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6957 -2.3862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4427 -1.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4240 -2.5832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5884 -3.3631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3164 2.7593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7953 3.4939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0607 3.9727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1857 -3.9115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0214 -3.1316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1704 3.8257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5026 4.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -2.6038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7812 -4.2780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9456 -5.0579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4528 -1.1291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -3.9978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 3.9083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1486 3.6607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5429 -5.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3786 -4.8264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.7938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.4138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 5.3943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8355 5.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7881 4.5662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0994 -6.7263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0787 -6.3927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7313 6.7263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8031 -0.8446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9669 -3.2561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4702 -1.7162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6777 -4.4128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1130 -0.0214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 2 0 0 0 0 2 22 2 0 0 0 0 3 26 2 0 0 0 0 4 38 1 0 0 0 0 4 89 1 0 0 0 0 5 38 2 0 0 0 0 6 39 2 0 0 0 0 7 44 1 0 0 0 0 7 93 1 0 0 0 0 8 46 1 0 0 0 0 8 94 1 0 0 0 0 16 9 1 6 0 0 0 9 20 1 0 0 0 0 9 56 1 0 0 0 0 17 10 1 1 0 0 0 10 26 1 0 0 0 0 10 61 1 0 0 0 0 11 22 1 0 0 0 0 30 11 1 1 0 0 0 11 69 1 0 0 0 0 23 12 1 1 0 0 0 12 39 1 0 0 0 0 12 74 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 75 1 0 0 0 0 14 36 1 0 0 0 0 14 87 1 0 0 0 0 14 88 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 21 1 6 0 0 0 15 49 1 0 0 0 0 16 22 1 0 0 0 0 16 50 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 17 51 1 0 0 0 0 18 27 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 24 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 23 60 1 0 0 0 0 24 29 1 0 0 0 0 24 31 2 0 0 0 0 25 28 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 28 33 1 0 0 0 0 28 67 1 0 0 0 0 28 68 1 0 0 0 0 29 32 1 0 0 0 0 29 35 2 0 0 0 0 30 34 1 0 0 0 0 30 38 1 0 0 0 0 30 70 1 0 0 0 0 31 71 1 0 0 0 0 32 37 2 0 0 0 0 33 36 1 0 0 0 0 33 72 1 0 0 0 0 33 73 1 0 0 0 0 34 42 1 0 0 0 0 34 76 1 0 0 0 0 34 77 1 0 0 0 0 35 40 1 0 0 0 0 35 78 1 0 0 0 0 36 79 1 0 0 0 0 36 80 1 0 0 0 0 37 41 1 0 0 0 0 37 81 1 0 0 0 0 39 43 1 0 0 0 0 40 41 2 0 0 0 0 40 82 1 0 0 0 0 41 83 1 0 0 0 0 42 84 1 0 0 0 0 42 85 1 0 0 0 0 42 86 1 0 0 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 44 47 1 0 0 0 0 45 46 2 0 0 0 0 45 90 1 0 0 0 0 46 48 1 0 0 0 0 47 48 2 0 0 0 0 47 91 1 0 0 0 0 48 92 1 0 0 0 0 M END $$$$