IFLAB-ZINC02723933 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 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 -0.6960 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0820 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7790 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0880 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6910 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.1090 -2.8740 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -1.7640 -3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.5930 -2.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -2.1240 -4.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -3.4270 -5.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -4.2850 -4.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -3.8110 -6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -2.8230 -7.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -3.1650 -8.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -4.5230 -9.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -5.5100 -8.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -5.1550 -6.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -7.0820 -9.0750 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -6.3340 -10.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -5.0570 -10.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1380 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -4.7740 1.2950 C 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 -0.1580 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6200 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -1.4400 -5.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -1.7800 -7.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -2.3920 -9.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -5.9200 -6.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -6.8700 -11.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -4.4640 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -4.4880 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -5.8560 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 23 24 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 M END