B8FMS1 -OEChem-04022104103D 41 43 0 0 0 0 0 0 0999 V2000 2.9948 -3.1136 -0.1849 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -0.3855 -1.1644 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6284 -0.7018 -0.3306 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9064 1.1613 0.5075 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7905 -1.0043 0.4984 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8735 -1.7724 -1.0839 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3499 -2.0076 -1.3995 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6271 0.1594 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6903 1.5258 -0.3335 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2796 -1.3235 -0.4271 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8868 1.9939 0.2338 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3693 2.4055 -0.6155 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7022 -1.9920 0.7219 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7163 -0.0228 -0.6776 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9874 3.3559 0.5068 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7219 -0.1411 0.2105 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2415 3.7617 -0.3324 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9383 4.2372 0.2294 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5616 -1.3596 1.6205 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5756 0.6097 0.2208 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9983 -0.0588 1.3698 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 -2.3833 0.2909 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1871 -2.9439 0.7309 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6593 -2.1599 -0.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2586 -2.3396 -1.7923 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5767 -1.6652 -2.4179 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5538 -3.0860 -1.3979 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9822 0.1622 -1.9002 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3059 2.0680 -1.0484 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3672 -3.0049 0.9291 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4016 0.5080 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9002 3.7533 0.9466 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 4.4444 -0.5472 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 5.2944 0.4538 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8903 -1.8798 2.5154 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9164 1.6221 0.0251 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6675 0.4336 2.0693 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6017 -0.5457 0.9061 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9913 -2.4945 0.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1999 -4.0272 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3478 -2.7306 1.7915 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 2 0 0 0 0 2 6 1 0 0 0 0 2 8 1 0 0 0 0 2 28 1 0 0 0 0 3 8 2 0 0 0 0 3 16 1 0 0 0 0 4 11 1 0 0 0 0 4 16 2 0 0 0 0 5 16 1 0 0 0 0 5 22 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 10 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 11 1 0 0 0 0 9 12 2 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 12 17 1 0 0 0 0 12 29 1 0 0 0 0 13 19 1 0 0 0 0 13 30 1 0 0 0 0 14 20 2 0 0 0 0 14 31 1 0 0 0 0 15 18 1 0 0 0 0 15 32 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END $$$$