IFLAB-ZINC05255638 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 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 -1.1890 -0.6320 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 0.0160 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -1.9780 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -2.6880 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 -3.4610 -1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -4.2060 -1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -3.9030 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -4.9730 -1.5970 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -5.8310 -2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -5.3250 -2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -5.8480 -3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -6.2630 -3.8180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -6.8980 -3.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -7.3210 -3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -6.7680 -2.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -8.4550 -4.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -8.8960 -4.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -9.9510 -5.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -10.5830 -5.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -10.1460 -5.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -9.0960 -5.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -11.9370 -6.9410 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -12.3940 -7.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -2.7850 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -3.3830 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 -1.9670 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -4.1750 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -2.7640 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -7.3390 -3.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 -8.4060 -3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 -10.2910 -5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -10.6380 -6.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -8.7610 -5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -11.5460 -8.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -13.2370 -8.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -12.6750 -6.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -2.1640 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -3.2070 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 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 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 3 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 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 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 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 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END