B3LJY0 -OEChem-04012112052D 68 72 0 0 0 0 0 0 0999 V2000 7.3564 -5.8043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2224 -1.3043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 -0.4526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4387 2.4390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6243 -5.8043 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 -1.3043 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5474 0.7835 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8564 1.7345 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0374 3.4571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0417 -6.1407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5417 -7.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7108 -5.3976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5198 -6.7988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 -5.3043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 -4.3043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6243 -3.8043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3564 -3.8043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 -2.3043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6243 -2.8043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3564 -2.8043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3564 0.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3564 -0.8043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1654 0.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5963 0.4745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8564 1.7345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4442 2.5436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8532 1.1436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3884 -0.5037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6252 4.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2185 5.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 0.8346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4374 -0.8127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 -0.1436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8063 5.9887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 5.2842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3995 6.9022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8172 6.1977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4050 7.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6268 -5.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5401 -6.5052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9753 -7.2589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7332 -7.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0208 -4.8606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2092 -5.0332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5846 -7.4154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1398 -6.7988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0874 -4.1143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8933 -4.1143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0874 -2.4943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8933 -2.4943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9534 -0.9943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7551 0.5919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9821 1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8492 -0.9186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0559 3.8201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1392 4.6128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4208 3.5219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4414 1.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3084 -1.4192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4229 5.9239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8595 4.7826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7640 7.4038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2006 6.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1528 7.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4149 0.6773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5392 0.6314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 -0.2442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 22 2 0 0 0 0 3 33 1 0 0 0 0 3 39 1 0 0 0 0 4 26 2 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 18 1 0 0 0 0 6 22 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 24 1 0 0 0 0 8 25 2 0 0 0 0 9 26 1 0 0 0 0 9 29 1 0 0 0 0 9 58 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 13 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 16 48 1 0 0 0 0 17 20 2 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 23 25 1 0 0 0 0 23 53 1 0 0 0 0 24 27 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 27 31 1 0 0 0 0 27 54 1 0 0 0 0 28 32 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 34 2 0 0 0 0 30 35 1 0 0 0 0 31 33 2 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 34 36 1 0 0 0 0 34 61 1 0 0 0 0 35 37 2 0 0 0 0 35 62 1 0 0 0 0 36 38 2 0 0 0 0 36 63 1 0 0 0 0 37 38 1 0 0 0 0 37 64 1 0 0 0 0 38 65 1 0 0 0 0 39 66 1 0 0 0 0 39 67 1 0 0 0 0 39 68 1 0 0 0 0 M END $$$$