IBS-ZINC04777148 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 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 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5120 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -2.0410 1.1940 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3770 -2.4060 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.4760 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -1.9660 -1.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -0.4980 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -2.4480 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -3.2600 -2.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7430 -3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -3.3790 -4.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -2.5240 -4.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -2.0880 -3.5790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -2.1070 -6.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -2.2410 -7.1980 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3180 -1.5340 -7.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -3.6700 -7.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 -3.8830 -5.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 -4.4480 -6.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.9480 -8.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -0.9070 -9.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.6360 -10.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -1.4100 -10.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -2.4540 -10.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -2.7240 -8.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -1.1450 -11.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -1.9820 -12.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -2.6170 1.2320 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 1.7540 -0.1020 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -0.1990 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 -2.0770 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -3.5650 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -0.1500 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -0.1080 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -4.4030 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -2.7360 -6.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -1.0680 -5.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -4.3870 -7.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -3.7900 -8.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -0.3050 -9.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 0.1770 -11.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -3.0570 -10.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -3.5390 -8.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -3.0160 -12.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -1.9050 -11.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -1.6640 -13.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -2.2530 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -3.7060 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -2.3040 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 30 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 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 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END