IFLAB-ZINC04583883 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.8510 2.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -4.5830 3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -4.0300 4.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -6.0880 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -6.6310 4.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -7.9870 4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -8.7660 3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -10.1020 3.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -10.7240 4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -10.0250 5.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 -8.6080 5.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 -7.9400 6.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -12.2300 4.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -14.2030 5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -14.6210 5.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -14.1030 4.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -14.6590 4.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -14.2120 3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -13.2040 3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -12.6510 2.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -13.1010 3.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -12.4730 3.6720 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -2.0380 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -2.0640 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.2930 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -6.4380 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -6.4120 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -8.3060 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -10.5360 6.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 -12.6000 3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 -12.5600 5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -14.4230 5.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -14.7460 4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -15.7080 5.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -14.2110 6.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -15.4460 5.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -14.6480 3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -12.8510 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -11.8640 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -12.8750 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -11.3940 3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -12.7560 4.8670 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 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 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END