IBS-ZINC06760025 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -0.6310 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -2.3570 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -3.1860 -0.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -4.5210 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 -5.5480 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -6.7830 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -6.7410 -0.5500 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -4.9910 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -4.0690 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -2.7770 -0.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -4.5020 -0.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -3.5320 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -4.2670 -0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 -3.2530 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2850 -3.9400 -0.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -8.0340 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 -7.6730 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3680 -6.4700 -0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6870 -5.2950 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 -7.4580 1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 -8.8070 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -5.4490 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -2.8320 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 -2.9860 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 -4.9670 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -4.8130 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 -2.5530 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -2.7070 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0570 -3.3580 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -8.3900 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 -8.8090 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -5.0800 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9530 -4.4510 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 -6.6480 1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9250 -7.2020 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 -8.3740 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5840 -9.7250 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9130 -8.5490 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9280 -8.9560 -1.4940 H 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 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 13 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 M END