B8PV2Q -OEChem-04012120182D 42 43 0 0 0 0 0 0 0999 V2000 7.2331 -1.2010 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.5670 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.2331 -2.9330 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6025 0.4581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 0.4581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 1.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 1.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 1.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 1.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 0.4581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 0.4581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 -0.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 3.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 1.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 2.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 23 1 0 0 0 0 3 23 1 0 0 0 0 4 7 1 0 0 0 0 4 12 1 0 0 0 0 5 19 1 0 0 0 0 5 39 1 0 0 0 0 6 19 2 0 0 0 0 7 15 2 0 0 0 0 8 22 1 0 0 0 0 8 24 2 0 0 0 0 9 22 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 19 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 16 23 1 0 0 0 0 17 35 1 0 0 0 0 18 21 2 0 0 0 0 18 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 24 26 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END $$$$