CHEMBRIDGE-ZINC00997488 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.3480 1.5320 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 0.0030 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -2.3600 2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -3.7290 2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5660 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -4.0350 0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -2.6660 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -6.0590 1.7640 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0190 -6.2690 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -6.5620 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -7.3040 1.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -7.7510 2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -6.7060 3.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -6.5550 4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -6.1810 3.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -5.5270 4.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -5.3680 3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7180 -7.1720 4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -7.7230 0.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -6.9220 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -6.6200 -1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -5.8540 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -5.3970 -2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -5.6830 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -6.4300 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -6.6460 0.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -7.4130 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 -7.6060 1.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -8.0300 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 1.8570 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 1.8980 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 1.9300 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -0.3220 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -0.3950 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -1.7060 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -4.1460 2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -4.6900 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -2.2510 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -7.8770 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -8.7020 3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -5.7730 5.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -7.5000 5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -5.4890 2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -4.6270 3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -5.0350 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 -8.1180 5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9270 -6.4230 5.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -7.3080 4.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -8.6530 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -6.9790 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -5.6120 -3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -4.8140 -3.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -5.3260 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 -7.7460 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -7.6730 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 -9.1150 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END