IFLAB-ZINC02696580 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0720 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8180 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -4.9120 -0.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -4.9390 1.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -5.0370 -0.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -5.2550 -2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -6.6490 -2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 -6.7800 -1.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 -6.6750 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -5.2880 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -7.9730 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 -8.2880 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8460 -9.4690 -1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 -10.3390 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 -10.0290 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -8.8450 -2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -11.1240 -4.2970 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2690 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5200 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0160 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -3.0120 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -4.5000 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -5.1920 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -6.7840 -3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -7.4060 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -6.8300 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -7.4320 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -5.2470 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -4.5370 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 -7.6100 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -9.7140 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 -11.2620 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -8.6010 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 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 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 48 1 0 0 0 0 M END