L2VJB1 -OEChem-05022322382D 43 45 0 0 0 0 0 0 0999 V2000 2.9176 1.7623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.2723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.7723 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 1.7277 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.7277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.7277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 2.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.7277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.7277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.7277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.7624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.3070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 2.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.7277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0574 2.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3947 2.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5976 2.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.3477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -1.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8612 2.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.8477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 0.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -1.9269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.5606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.1052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0382 1.6908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2651 2.5377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4182 2.7646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2422 0.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4822 0.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3736 2.8056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5241 2.5885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7413 1.7390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 23 1 0 0 0 0 2 14 2 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 3 27 1 0 0 0 0 4 10 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 12 2 0 0 0 0 6 13 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 7 17 1 0 0 0 0 8 10 1 0 0 0 0 8 15 2 0 0 0 0 8 16 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 12 15 1 0 0 0 0 12 28 1 0 0 0 0 13 16 2 0 0 0 0 13 29 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M END $$$$