IBS-ZINC02407512 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 1 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 0.0510 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 0.7200 1.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -0.1730 2.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 0.4210 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -0.1480 -1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.9100 -2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -1.9180 -2.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -0.5560 -3.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -1.3840 -4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -0.7730 -5.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 0.1450 -6.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 0.7060 -7.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 0.3480 -7.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2660 -0.5700 -7.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5450 -1.1340 -6.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5830 1.0640 -9.2090 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.9530 0.9650 -8.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 2.2970 -9.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3780 0.0890 -10.5320 N 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 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 1.5050 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 0.0410 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 0.1640 4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 0.6550 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 0.2480 -3.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -1.4400 -4.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -2.3870 -4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 0.4240 -6.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 1.4230 -8.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2980 -0.8490 -7.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -1.8540 -5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0790 0.0220 -11.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -0.4150 -10.6400 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 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 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 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END