IFLAB-ZINC04338393 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 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 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -2.6700 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0290 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -2.7810 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -3.2030 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -3.9190 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -4.4630 -1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -4.2820 -2.9630 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -3.6020 -3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -3.0690 -2.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -3.4280 -4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -3.9760 -5.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -3.8120 -7.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -3.1040 -7.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -2.5580 -6.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -2.7210 -5.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.0420 -4.0370 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -5.2240 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 -5.3810 -0.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 -5.7430 -2.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -3.9020 0.6650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -4.3150 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -3.2080 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -3.0010 2.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0300 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 -2.4280 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -3.7490 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -4.5280 -5.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -4.2360 -7.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -2.9780 -8.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -2.0070 -6.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -5.6180 -3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -6.2420 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 M END