B8N4LW -OEChem-04022109572D 43 46 0 0 0 0 0 0 0999 V2000 6.4071 0.4266 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -4.6612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7469 4.6137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -3.1612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7891 0.4266 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.6612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.6612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -5.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -4.1612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -2.6612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -1.6612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -3.1612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.1612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -2.6612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -1.6612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -0.1612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 1.3776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5103 2.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 1.3776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5158 2.0821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 3.1002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 2.8911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3292 3.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3347 3.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1537 5.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8395 -4.0623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8923 -4.0506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4174 -4.8733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -5.9258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -5.9258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3291 -2.8512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1951 -1.3512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -3.7812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 -2.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 -1.3512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4625 1.8792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2636 1.5157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5336 3.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3114 2.8263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5814 4.4756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7201 5.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4058 6.0936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5873 5.7794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 19 1 0 0 0 0 2 9 2 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 31 1 0 0 0 0 5 16 2 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 13 2 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 36 1 0 0 0 0 20 22 1 0 0 0 0 20 37 1 0 0 0 0 21 23 2 0 0 0 0 21 38 1 0 0 0 0 22 24 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$