IBS-ZINC04812522 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 0.9880 0.1730 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -1.3270 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -1.5490 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -3.0480 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -3.2610 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 -3.2930 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -3.1480 -2.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -3.5090 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5060 -3.5540 -2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9720 -3.2380 -3.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7640 -3.4020 -4.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -2.9760 -5.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 -2.9690 -8.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7400 -3.2070 -9.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8560 -2.3130 -9.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6920 -2.4530 -8.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8600 -2.2080 -7.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3100 -3.6750 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5050 -3.8570 0.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -3.6190 1.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -3.4240 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -3.3890 2.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 0.3310 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 0.6760 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 0.5790 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -1.7330 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -1.8300 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -1.1420 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -1.0460 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -3.4550 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -3.5510 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 -3.8430 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -2.9020 -3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 -4.4480 -4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6590 -2.7830 -4.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -1.9300 -5.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -3.5950 -5.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 -3.6860 -8.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -1.9560 -8.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -3.0250 -10.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 -4.2360 -9.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5030 -1.7270 -8.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1070 -3.4610 -8.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4900 -1.1830 -7.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4800 -2.3690 -6.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8560 -3.7260 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 -3.1400 -7.1340 N 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 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 M END