IBS-ZINC04137409 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 4.9150 0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 5.8140 -0.6740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0400 5.6960 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 7.2450 -0.3940 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6560 7.0630 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 5.5960 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 5.0840 1.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 7.9350 1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 8.0480 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 7.4850 0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 9.5140 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 10.1670 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 11.5410 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 12.2780 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 11.6410 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 10.2620 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 12.3720 1.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 13.7900 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 5.5180 -2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 5.5690 -2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 5.2980 -4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 4.9750 -4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 4.9240 -4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 5.1900 -2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 4.5200 -4.7840 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 7.7290 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 9.5940 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 12.0440 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 13.3550 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 9.7660 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 14.2510 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 14.0360 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 14.1650 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 5.8220 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 5.3380 -4.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 4.7640 -5.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 5.1460 -2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 52 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 2 0 0 0 0 13 15 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 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 M END