BS4JE3 -OEChem-04022107073D 41 42 0 1 0 0 0 0 0999 V2000 -2.3548 -2.2027 1.5148 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 1.7029 -1.7017 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.0861 -0.9173 -2.1291 F 0 0 0 0 0 0 0 0 0 0 0 0 1.6419 2.3851 0.1804 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8875 -2.4870 0.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4963 0.4790 -0.8444 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6943 -1.3244 -0.0253 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4731 1.5455 2.8201 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 1.1922 1.6234 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5590 1.2197 -1.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6004 0.3307 0.7394 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9258 0.9935 -0.8844 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6228 1.1637 0.0063 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -0.9697 -1.0545 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5915 0.4706 2.0726 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -0.4596 -0.9721 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3558 -1.6460 -0.0224 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5264 0.0965 0.9485 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8604 -1.2402 0.7308 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0572 1.0906 0.1267 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 0.7482 -0.9128 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7253 -1.5828 -0.3087 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2561 -0.5885 -1.1306 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5797 2.1202 1.1099 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3353 2.2918 -1.5031 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5651 0.9210 -2.5798 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0999 -0.4457 1.3288 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0121 -0.1626 -0.0224 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9093 1.3208 0.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 1.6194 -1.4109 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8295 -1.2068 -2.0639 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4629 -1.3634 -0.9651 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3214 -0.4239 2.6498 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1532 1.1114 2.7666 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2371 -0.8633 -1.9802 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4457 -0.5238 -0.7319 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2738 -1.7926 0.6649 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0865 2.1463 3.4243 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2906 2.0925 2.5531 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8148 2.1372 0.2879 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9851 -2.6234 -0.4784 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 21 1 0 0 0 0 3 23 1 0 0 0 0 4 13 2 0 0 0 0 5 17 2 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 9 24 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 16 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 14 17 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 22 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 M END $$$$