CHEMDIV-ZINC00896512 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 0.0980 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -0.5540 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -1.9690 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -2.7040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -2.0390 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -2.7490 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -4.1730 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -2.5700 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -1.8520 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -0.5220 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 0.1640 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 1.5430 0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1700 -2.5100 0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2850 -1.5540 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6050 -2.3110 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6770 -3.3670 0.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5330 -4.2820 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2550 -3.4470 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7610 -3.4930 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6960 -2.7300 1.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8130 -4.5820 2.7510 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.9420 -4.5100 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8340 -5.9540 2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8970 -6.9620 3.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8010 -6.7700 4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1720 -7.8420 4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0880 -7.6620 5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6360 -6.4130 6.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2720 -5.3410 5.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3540 -5.5160 4.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0090 -4.4510 3.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 1.1760 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -3.7830 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -4.4870 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -4.6160 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -4.5040 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 2.0330 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 2.0230 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2930 -1.0210 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1640 -0.8400 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4410 -1.6230 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6420 -2.7590 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6600 -4.8960 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4670 -4.9190 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3870 -4.1060 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2780 -2.8880 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7080 -6.0280 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9260 -6.0820 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7460 -8.8180 4.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3750 -8.4980 6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3500 -6.2750 6.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7020 -4.3670 5.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 34 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 33 34 1 0 0 0 0 M END