IFLAB-ZINC04941708 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.8710 2.1340 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 0.6140 1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 0.0250 1.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -1.4000 1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 -1.9190 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -3.4450 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 -3.9420 0.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -5.2650 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 -6.0440 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 -5.7720 0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2850 -4.9930 0.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5760 -7.0950 0.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8780 -7.5750 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9560 -6.8900 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0600 -7.7230 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6800 -8.8750 0.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3140 -8.8060 0.6980 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5330 -9.8250 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0390 -10.5950 2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2680 -11.5980 2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9910 -11.8360 2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 -11.0680 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 -10.0680 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 -12.8170 2.9190 F 0 0 0 0 0 0 0 0 0 0 0 0 -11.3620 -7.1330 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8080 -5.7080 -1.6470 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.2100 -5.5100 -0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 2.5840 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 2.5200 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 2.3800 2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 0.3680 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 0.2280 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -1.6880 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -1.8280 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 -1.6310 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8180 -1.4910 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -3.7330 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 -3.8730 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -3.3200 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8290 -7.7130 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0350 -10.4100 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6620 -12.1970 3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 -11.2550 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 -9.4730 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8910 -7.8590 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9920 -6.7980 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2940 -4.7640 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4190 -5.2420 -1.4730 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 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 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 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 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 40 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END