IFLAB-ZINC02712418 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0210 1.5450 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.0150 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -0.4990 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -2.0300 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -2.5450 1.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -2.0470 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -0.5160 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -3.4570 1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -3.8600 2.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -3.9750 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -5.1770 3.1350 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -5.6060 2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1480 -6.5180 3.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 -6.9230 4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4180 -6.8590 3.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0220 -7.6750 3.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0310 -6.2580 2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3060 -5.3330 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 -5.0330 1.6750 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8810 -4.7230 0.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3550 -6.5860 1.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6760 -7.8590 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8450 -8.7410 1.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0280 -8.1830 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4720 -9.4310 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7860 -9.4480 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3970 -8.2580 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3380 -7.0300 0.7290 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 1.9230 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.9110 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8900 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.3300 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 -0.1020 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -0.1760 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -2.3540 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.4050 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -2.3720 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4230 -2.4330 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -0.1920 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -0.1300 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 -3.1450 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -4.4560 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7920 -4.9400 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3730 -4.0780 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0350 -5.8950 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8540 -10.3150 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2880 -10.3570 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4240 -8.0970 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 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 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 M END