PUBCHEM-ZINC06071175 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.0450 1.5620 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 0.0720 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -0.7590 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -2.1470 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -2.7310 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -1.8970 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -0.5070 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -4.1560 -0.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -4.9580 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -6.2490 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -6.1830 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -4.9140 0.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -7.2990 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -7.4080 -1.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -7.5780 -1.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -8.6040 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -9.9250 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -10.9900 -2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 -10.7460 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -9.4390 -4.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -8.3450 -3.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 -6.9520 -4.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -5.9960 -3.7640 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2410 -4.4690 -2.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 1.9610 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 2.0290 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 1.8480 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -0.3330 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -2.7600 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -2.2820 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 0.1190 -1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 -7.8460 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -6.9410 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -7.9980 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -10.1180 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -12.0040 -2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -11.5670 -4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 -9.2620 -5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -5.2290 -2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -6.8240 -5.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 40 2 0 0 0 0 24 39 1 0 0 0 0 M CHG 1 23 -1 M END