IFLAB-ZINC05147021 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -2.6880 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -2.0960 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -4.1950 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 -4.7170 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 -5.0370 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -5.5940 -0.6440 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 -5.3470 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 -4.8740 1.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 -4.6860 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5650 -5.0550 3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4620 -5.4480 2.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 -5.0200 4.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 -5.4300 5.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2090 -5.3970 6.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1980 -4.9570 7.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 -4.5480 6.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -4.5840 5.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 -4.9250 8.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3160 -4.4610 9.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7280 -4.4960 11.0340 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 0.5120 -0.3560 -0.8950 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -2.4720 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -4.5460 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -4.5560 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1690 -4.9730 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 -4.3160 3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 -5.7720 4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1550 -5.7130 6.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -4.2060 7.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 -4.2700 5.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4500 -5.1040 9.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -3.4390 9.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5950 -3.8530 11.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9800 -5.5190 11.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -4.1430 11.6500 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 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 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 22 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M END