IFLAB-ZINC02701960 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -0.7350 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -1.1370 -2.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -1.1470 -3.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.7590 -2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -0.6220 -2.8350 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -1.1560 -4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -1.1190 -5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 -0.2740 -6.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5610 -0.2370 -6.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 0.6520 -7.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 0.6810 -8.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1140 -0.1670 -7.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8200 -1.0500 -6.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 -1.0940 -6.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -0.5880 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3150 -1.1080 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -0.8360 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 -0.1010 1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 0.2970 1.1940 S 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -0.4880 -5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1730 -4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -1.7800 -4.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 0.3880 -6.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 1.3150 -8.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3740 1.3680 -9.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1100 -0.1400 -8.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5870 -1.7100 -6.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3190 -1.7870 -5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 -1.6910 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 -1.1900 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 0.2060 2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 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 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 M END