BY96EM -OEChem-04012115113D 42 44 0 0 0 0 0 0 0999 V2000 -7.2348 0.6050 -1.2156 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.0688 1.5151 0.7460 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.3803 -0.6294 0.5685 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0491 -2.7617 -0.0546 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5971 -1.6256 -0.0688 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1447 -1.8099 -0.0128 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0916 2.5343 0.0728 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8681 3.1086 0.0717 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6706 2.0681 0.0279 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8354 -0.4314 -0.0208 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2197 0.6919 -0.0188 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7541 0.8369 0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0332 2.0640 0.0419 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1986 -0.4324 -0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0790 1.1652 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1849 0.7845 -0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4639 -0.2381 -0.0297 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 3.3709 0.1046 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -0.4657 -0.0496 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9053 -1.6889 -0.0241 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2204 0.1895 0.0055 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3141 -1.2120 0.4942 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9919 0.9496 -0.5358 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6923 -0.9983 0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3702 1.1634 -0.5183 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6942 0.4176 0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6329 -4.0688 -0.0739 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5273 -5.1023 -0.1063 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 0.5908 0.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6732 1.5983 0.0406 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2371 3.9722 1.0166 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1630 2.7440 0.1007 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2574 4.0121 -0.7802 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9227 -2.1419 0.8981 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3744 1.7193 -0.9885 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3372 -1.7688 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7738 2.0881 -0.9224 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2643 -4.1711 -0.9632 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2447 -4.2063 0.8243 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8766 -4.9979 0.7682 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8959 -4.9633 -0.9902 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9389 -6.1153 -0.1217 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 20 1 0 0 0 0 4 27 1 0 0 0 0 5 19 2 0 0 0 0 6 20 2 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 18 1 0 0 0 0 8 13 2 0 0 0 0 9 13 1 0 0 0 0 9 16 2 0 0 0 0 10 14 2 0 0 0 0 10 16 1 0 0 0 0 11 16 1 0 0 0 0 11 19 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 14 20 1 0 0 0 0 15 29 1 0 0 0 0 17 19 1 0 0 0 0 17 22 2 0 0 0 0 17 23 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 21 26 1 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 23 25 2 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 27 28 1 0 0 0 0 27 38 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M END $$$$