CHEMDIV-ZINC06797182 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -4.1790 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 -2.6270 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 -2.8560 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7510 -3.5350 -1.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3600 -3.8420 -2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8330 -3.5550 -3.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6950 -4.5400 -2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1410 -4.7600 -3.9250 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7910 -5.9330 -4.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2080 -6.1570 -5.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8460 -7.3370 -6.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0770 -8.2550 -5.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6980 -7.9680 -4.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0560 -6.8410 -3.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9840 -5.2070 -6.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5100 -5.1760 -7.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1900 -4.0150 -7.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0880 -3.2870 -6.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3340 -4.0410 -5.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8920 -3.8250 -4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1980 -2.8030 -3.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -3.7480 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -4.6370 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -3.5870 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -2.0100 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 -1.8960 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -3.4730 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1720 -3.7650 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5990 -5.5000 -2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4240 -3.9230 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1570 -7.5340 -7.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7770 -9.1830 -6.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 -8.6810 -3.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4060 -5.9510 -8.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7170 -3.7060 -8.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5190 -2.3160 -6.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 M END