B79LMD -OEChem-04012117112D 41 44 0 0 0 0 0 0 0999 V2000 4.6660 2.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8901 -0.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8901 1.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7962 0.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7962 1.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7966 2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9996 2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0555 -0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -1.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.7496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 2.5596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7272 0.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 1.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8829 -0.7496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8829 2.5596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3319 0.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3319 1.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 24 1 0 0 0 0 2 41 1 0 0 0 0 3 24 2 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 5 10 2 0 0 0 0 6 12 2 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 14 2 0 0 0 0 8 12 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 11 1 0 0 0 0 9 15 2 0 0 0 0 10 13 1 0 0 0 0 12 17 1 0 0 0 0 13 24 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 20 1 0 0 0 0 14 31 1 0 0 0 0 15 21 1 0 0 0 0 15 32 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 22 2 0 0 0 0 17 19 2 0 0 0 0 17 33 1 0 0 0 0 18 23 2 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 25 1 0 0 0 0 22 37 1 0 0 0 0 23 26 1 0 0 0 0 23 38 1 0 0 0 0 25 26 2 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$