CHEMBRIDGE-ZINC04745099 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -1.7570 -0.6460 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8110 -2.4840 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 -2.2470 -0.4670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0500 -3.2260 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -1.2510 -1.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8180 -0.2850 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -1.0970 -2.6050 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1520 -0.3480 -3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -0.6510 -2.7010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9350 0.3230 -2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -1.6060 -2.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -0.5530 -4.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -0.0180 -4.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 0.1330 -5.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -0.1730 -6.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 0.6820 -5.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -2.3690 -3.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -2.3260 -4.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -1.2610 -5.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -3.6070 -5.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2560 -1.7440 -1.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 -0.8260 -0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 0.3510 -0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6720 -1.2630 -0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -2.3480 0.9610 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -3.4630 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -4.3820 1.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -3.5660 3.1140 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 0.7570 -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 -1.6720 -1.5440 -4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 0.1070 -4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -0.1380 -5.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 1.2190 -6.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 1.3640 -4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -4.4570 -4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1990 -3.6440 -5.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -3.6450 -6.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7210 -2.3510 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1040 -0.8690 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2310 -0.8830 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -1.6120 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -2.6510 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 -4.4150 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -3.7090 3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END