BK3S6U -OEChem-04022118003D 38 40 0 1 0 0 0 0 0999 V2000 -5.0258 0.8183 0.4908 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5838 0.2092 0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4466 -1.1439 0.0094 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7864 -0.5136 1.0408 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1229 -0.3107 1.0917 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7739 0.8222 -1.0341 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3854 -0.1594 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1022 0.0318 0.0802 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1285 -1.3484 0.0141 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6146 -2.7295 -0.0291 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9592 1.5692 -0.4433 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3326 0.8343 0.0864 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2046 -0.1175 -2.1622 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8098 0.6560 0.3959 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0127 -3.4843 -1.3196 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0336 -3.5706 1.1999 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2933 2.2562 0.1352 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 0.9436 0.0677 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4451 2.9527 0.1481 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7336 2.2844 0.1132 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 1.5482 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4824 -2.7012 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5746 2.0142 -1.2326 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6095 2.3777 0.2103 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7027 0.4377 -2.9636 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3331 -0.6228 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8876 -0.8979 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -3.6185 -1.3861 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -2.9293 -2.2067 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5451 -4.4742 -1.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1199 -3.7079 1.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5666 -4.5607 1.1683 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7231 -3.0784 2.1282 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3404 2.7729 0.1701 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6136 -0.9135 1.7444 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7033 0.3861 0.0403 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4385 4.0365 0.1886 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6359 2.8835 0.1252 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 18 1 0 0 0 0 3 9 2 0 0 0 0 4 5 1 0 0 0 0 4 8 2 0 0 0 0 5 14 1 0 0 0 0 5 35 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 2 0 0 0 0 9 10 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 10 22 1 0 0 0 0 11 14 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 17 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 20 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 M END $$$$