IBS-ZINC02135593 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.1980 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 1.8480 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 3.0860 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 3.1220 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 1.9990 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 0.8050 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 0.6790 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.4060 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 -1.3320 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 -0.4100 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4100 -1.5520 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 -2.6830 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3970 -2.6880 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8060 -1.5490 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0140 -0.4150 -0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0040 -1.8100 -1.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1260 -3.2450 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 -3.6610 -0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5130 4.4280 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8690 5.4590 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 4.4740 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5480 5.7670 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0610 5.5390 -0.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3410 4.9710 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7950 6.8940 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6750 6.8420 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7700 5.3180 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4600 4.8270 1.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 4.0010 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4780 -1.5510 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8850 -3.5660 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3280 0.4670 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7180 -3.6590 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1670 -3.5420 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3730 3.6510 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2570 6.3340 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2740 6.3250 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4160 6.9960 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0810 7.7150 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6610 7.2660 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1880 7.3520 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5360 4.8650 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9750 5.1240 2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 33 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 32 33 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 M END