IFLAB-ZINC04251305 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2020 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 0.0220 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4080 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.0820 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 1.9190 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 0.6500 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -0.4650 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0580 -1.7690 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 -2.0920 -0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -2.8270 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -4.4700 -0.0550 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -5.5570 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -6.9400 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -7.7540 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -7.1410 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -5.8180 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -5.0640 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -7.9690 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -7.3580 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 -8.1310 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 -9.5160 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -10.1280 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -9.3600 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 -10.2990 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 -11.6690 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8680 -12.0010 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5880 -10.8700 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 -9.8440 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.7620 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 3.1620 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 2.5160 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 2.5060 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2830 0.6220 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 0.6130 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 -2.7210 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -2.7120 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -7.3610 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -8.8300 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -6.2810 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 -7.6580 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -11.2060 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -9.8360 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -12.3500 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2650 -13.0060 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -8.8060 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 30 49 1 0 0 0 0 M END