IFLAB-ZINC04167075 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 -5.3460 -8.1810 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -8.8670 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8550 -10.5850 0.5830 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 -10.1940 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -8.9010 -0.9150 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 -11.1770 -1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4810 -12.5430 -1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -13.4550 -2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -13.0180 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -11.6650 -3.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -10.7430 -2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -14.0200 -4.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -14.2780 -5.4920 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -13.5040 -4.9790 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -15.2080 -3.7640 F 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 -6.5660 -8.4410 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 -12.8860 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -14.5130 -2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -11.3300 -4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 -9.6870 -3.0060 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 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 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M END