IFLAB-ZINC04315771 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 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 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1030 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -0.5360 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -1.9140 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -2.6670 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.0210 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -4.1440 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -4.7980 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -4.7660 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 -6.2300 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 -6.6750 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 -8.4840 0.0080 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.1060 -8.7130 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7500 -9.9130 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3360 -10.7900 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1070 -9.6410 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2330 -8.2880 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0050 -7.7540 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.2060 -10.6300 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5340 -10.2020 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5550 -11.1290 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2640 -12.4830 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9480 -12.9140 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9190 -11.9960 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5540 -13.6440 0.0580 Cl 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 -2.3300 1.1820 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 0.0460 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 -2.4100 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -2.5980 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -4.2440 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -6.6100 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -6.6200 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7680 -6.2950 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7850 -6.2850 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1620 -7.7390 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7620 -9.1460 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5830 -10.7990 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7280 -13.9710 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8930 -12.3340 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END