IBS-ZINC04736995 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 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 0.0610 -4.2750 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0760 -4.6480 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -4.7690 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -6.2790 -0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -6.9710 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -8.4830 -0.8850 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6120 -8.8070 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -9.0010 -1.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -8.2490 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -9.0100 -1.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -10.2420 -1.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -10.2790 -1.6210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 -11.4050 -2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -6.9100 -0.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -9.0140 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -9.7860 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -10.2750 1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -9.9900 2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -9.2160 2.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -8.7330 1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -8.9370 3.9130 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -11.0290 1.9320 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -6.3040 -0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -6.9550 -0.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -4.8050 -0.7450 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 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 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 1.2930 -4.3750 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 -4.4230 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 -11.9480 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 -12.0720 -2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -11.0350 -2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 -6.4310 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -10.0090 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -10.3700 3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -8.1320 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -4.5170 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -4.3900 -1.7520 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 21 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 45 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 46 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 48 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 M END