BU40GH -OEChem-04042104243D 50 51 0 0 0 0 0 0 0999 V2000 5.9192 -0.8830 -1.0197 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3575 2.4227 -0.1922 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 0.7190 1.5949 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6241 -1.3228 0.1743 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8009 -1.7726 -2.1638 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1849 -0.9497 2.4526 O 0 5 0 0 0 0 0 0 0 0 0 0 5.6695 1.1192 1.9013 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2553 0.3206 -0.6066 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 1.3181 -0.6131 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0024 0.0694 1.7459 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.3123 -1.5396 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -1.9644 0.1092 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4048 -0.0356 0.5435 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1075 -1.1057 -0.9191 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6399 0.7822 -0.4944 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0160 -2.3538 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2066 1.2269 -0.4554 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8115 0.6809 -0.6268 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7924 1.7848 -0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 0.8160 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7055 0.3996 0.0863 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3029 -0.3826 -0.5647 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0043 0.0332 0.7328 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7056 0.4244 1.0583 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0042 -0.0161 -1.2113 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3028 -0.4072 -1.5368 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7023 0.6159 -1.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8188 -1.7351 -0.7105 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7802 -3.0188 -0.1841 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3402 -1.8692 1.0809 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9901 0.1680 1.5393 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4537 0.2822 0.5593 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0613 -1.4124 -0.9626 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5311 -1.2627 -1.9183 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1017 0.6762 -1.4832 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6773 1.8433 -0.2285 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5524 -2.1990 2.3072 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9729 -3.4236 1.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0706 -2.0689 1.4025 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7102 0.2555 -1.6316 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6415 -0.1118 0.1103 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9471 2.5888 -1.1612 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8817 2.2255 0.5677 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0474 1.4241 -1.5404 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4781 0.7524 2.0705 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -0.0791 -1.9899 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5086 -0.7247 -2.5551 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7213 0.3718 -1.8739 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1454 1.0185 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7259 1.3321 -0.7431 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 22 1 0 0 0 0 1 27 1 0 0 0 0 2 17 2 0 0 0 0 3 20 2 0 0 0 0 6 10 1 0 0 0 0 7 10 2 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 17 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 9 44 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 11 28 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 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 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$