L8JG4M -OEChem-05022322392D 42 43 0 0 0 0 0 0 0999 V2000 2.0000 -2.5704 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9249 0.8162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.9296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.9296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2257 2.5220 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4960 3.8804 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.9296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.7956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 1.9296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.6616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0981 2.7956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 3.6616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5829 1.7559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2105 2.3483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8533 3.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5730 2.3971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5730 3.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0155 1.7175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7057 1.3190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1807 3.8737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4904 4.2722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6231 3.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6231 2.3971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7057 4.2722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0155 3.8737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 0.4546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0136 3.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9984 1.7657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7474 2.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.7604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.7604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.3804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.8804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -3.8804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 8 1 0 0 0 0 4 15 1 0 0 0 0 4 34 1 0 0 0 0 5 14 1 0 0 0 0 5 17 1 0 0 0 0 5 35 1 0 0 0 0 6 23 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 22 3 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 15 16 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 22 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 19 21 2 0 0 0 0 19 39 1 0 0 0 0 20 23 2 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 M END $$$$