B2KDC1 -OEChem-04012113202D 43 44 0 1 0 0 0 0 0999 V2000 10.3972 -0.5261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2690 0.9706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.5019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1292 -0.5327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.0019 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0010 0.9981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.5019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.4981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.9981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 -0.5366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 1.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 -0.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 1.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.5019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2651 -0.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9972 -0.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1254 -1.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8613 -0.5394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 1.5807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3905 0.8904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 -0.9769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 -0.9769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 1.9730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 1.9730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.1219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6199 -1.1565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6199 2.1527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 0.4730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 0.4730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0688 1.3310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3975 0.4373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6005 0.4404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5054 -1.5304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1230 -2.1527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7454 -1.5351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5492 -1.0752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3970 -0.8515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1733 -0.0037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 17 1 0 0 0 0 2 17 2 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 3 29 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 11 13 2 0 0 0 0 11 30 1 0 0 0 0 12 15 2 0 0 0 0 12 31 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 21 3 0 0 0 0 18 20 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 M END $$$$