IFLAB-ZINC01780846 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.0750 1.4270 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.0950 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -0.6070 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -2.0280 -0.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -2.6450 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -4.0260 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -4.6560 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 -3.9040 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9750 -2.5140 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -1.8940 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3680 -4.5720 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4670 -5.8270 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -6.4510 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4280 -6.9460 1.6130 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9950 -6.6970 0.4160 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2460 -7.2320 1.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9010 -5.8340 -0.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7350 -8.0750 -0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3190 -9.2850 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 -10.3660 -0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3270 -10.2370 -2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7440 -9.0270 -2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9520 -7.9480 -2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 1.7920 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.8790 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 1.6950 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -0.3630 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -0.5460 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -0.3380 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -0.1550 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -4.6050 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 -5.7290 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8710 -1.9290 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -0.8220 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2510 -4.0590 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -9.3860 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7900 -11.3120 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1670 -11.0820 -2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9090 -8.9260 -3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2810 -7.0030 -2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 3 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 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 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 M END