IBS-ZINC01245531 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8170 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -3.0910 -2.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0000 -2.1640 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -3.7920 -4.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 -5.1180 -4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -5.9870 -4.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -5.1800 -2.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -4.0910 -2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -3.9340 -0.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -6.3400 -2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -7.3170 -1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -7.2190 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -8.1130 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -9.1090 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -9.2080 -2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -8.3120 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -10.1840 -2.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -10.2240 -4.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -9.9890 -0.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -9.8270 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.8440 2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8480 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -3.2150 -5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -3.9460 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 -6.0140 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -6.8230 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -6.4430 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -8.0340 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -8.3890 -3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 -10.3720 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -9.2840 -4.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -11.0470 -4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -8.8400 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -9.9280 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -10.5920 1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -3.0420 2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -3.7890 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -2.2520 3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 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 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END