IBS-ZINC04311433 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 53 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7840 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3920 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -1.3960 3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -2.7320 3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -3.1360 1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.1440 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.2000 -0.6850 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0040 -0.7530 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.3430 -2.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -2.8730 -1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -3.0700 -2.6710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6920 -2.1510 -3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -4.1460 -2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 -4.2080 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -3.4700 -0.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 -4.9890 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 -4.9690 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6810 -5.7030 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 -6.4580 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 -6.4830 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -5.7580 -1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -3.5490 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -4.1470 -4.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -4.5800 -4.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -4.4130 -4.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -3.8240 -2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -3.3910 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -2.8930 -1.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 0.6510 2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -1.1260 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -3.4800 3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -4.1820 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -5.1060 -3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2570 -3.8490 -3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -4.3790 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 -5.6870 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2420 -7.0300 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 -7.0740 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 -5.7820 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -4.2740 -5.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -5.0470 -5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -4.7460 -4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -3.6960 -2.3860 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 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 24 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 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 M END