IFLAB-ZINC04032998 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0140 1.3650 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0160 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -0.6920 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 0.0270 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.4130 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0800 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 2.1410 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 1.6680 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 0.5730 1.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 2.4980 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0030 1.7500 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7410 2.8090 2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 4.1640 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 3.7840 1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -2.1760 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -2.9920 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -4.2770 -0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -5.4860 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -6.6200 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -6.5240 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -5.3490 0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -4.2190 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -2.9440 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.8870 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -0.5710 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.4920 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1600 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 2.9860 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2760 2.7480 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 1.0090 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6990 1.2640 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 2.5820 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7950 2.8370 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 4.7780 2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6250 4.6850 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 4.5710 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 3.5760 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -2.6820 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -5.5400 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -7.5870 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -7.4220 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 M END