CHEMDIV-ZINC04955515 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -0.9090 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -0.4550 1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -1.5630 2.9330 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 -1.7360 3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -3.2180 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -3.5930 4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -2.1270 3.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -5.0460 5.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -5.3940 6.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -5.1270 7.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -5.4460 8.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -6.0340 8.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -6.3020 6.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -5.9870 5.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8240 -1.4370 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.1160 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.0550 -2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -1.0600 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -2.1120 -1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -1.8950 -2.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -2.4780 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -0.7160 -2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -0.2250 -2.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -1.7250 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.1920 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1050 -1.1420 4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -1.4170 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -3.3490 4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -3.7980 2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -4.1680 3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -3.9960 4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -2.0670 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -1.5710 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -5.7450 4.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -5.1100 5.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -4.6680 7.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -5.2360 9.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -6.2820 9.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -6.7610 6.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -6.2000 4.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -2.9630 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -0.2580 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -3.6800 4.6700 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 18 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 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 49 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 M END