IBS-ZINC05025723 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.0440 1.5320 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.0260 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -0.6830 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -2.0640 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.7400 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -2.0260 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -0.6450 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.1410 -0.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -4.8110 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -4.2150 -2.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -6.2840 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -7.0370 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -6.3580 -3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -8.3790 -2.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -9.1680 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -10.6520 -3.1100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3380 -10.8210 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -11.4920 -4.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -12.4550 -4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -12.4460 -2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -11.0770 -2.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -6.9190 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -8.1300 0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -6.1210 1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -4.7850 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -4.1230 2.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 1.9120 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 1.9010 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 1.8730 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -0.1560 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -2.6170 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -2.5490 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -0.0890 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -5.8620 -3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -7.1000 -4.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -5.6190 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -8.8220 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -8.8600 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -9.0050 -4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -12.0540 -4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -10.8530 -5.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -13.4550 -4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -12.0720 -5.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -13.1250 -2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -12.7090 -2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -6.5230 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 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 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 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 46 1 0 0 0 0 25 26 2 0 0 0 0 M END