IBS-ZINC06661749 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 37 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3790 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 1.5210 1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 0.8490 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -0.1090 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 0.5650 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -0.6520 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -2.0070 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 -2.7020 0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 -2.1200 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 -0.7220 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 0.0410 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 1.2560 -0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3910 -0.3870 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0890 -1.4890 -0.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2270 -2.5850 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6140 -3.9290 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7150 -4.3780 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0940 -5.7040 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3790 -6.5840 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 -6.1400 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -4.8140 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9020 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 2.1580 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 0.9600 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -0.7450 -1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 0.4570 -1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -2.5310 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7910 0.6120 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2740 -3.6920 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9500 -6.0540 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6770 -7.6200 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -6.8300 1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 -4.4670 1.3500 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 M END