IFLAB-ZINC05145871 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3570 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -0.5130 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -2.0180 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -2.6920 0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -2.0330 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -3.1330 -0.0420 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -4.4870 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -4.1170 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -5.0640 1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -5.3070 2.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -5.6670 0.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -6.5390 0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -6.7810 2.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -7.1420 0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -8.0690 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -5.7840 0.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -6.0430 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 -5.1370 -0.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 -7.4160 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 -7.8030 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5620 -9.1540 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 -9.8510 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -8.8290 0.6630 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -0.5360 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 0.0010 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -0.3220 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -2.2000 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -2.4190 2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -5.4740 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 -8.4820 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 -7.5430 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -8.8760 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -6.5060 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0930 -7.1170 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5010 -9.6200 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 -10.9190 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -0.0500 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -0.3330 -0.9420 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 2 4 1 0 0 0 0 2 26 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END