IBS-ZINC05150306 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 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 -2.3770 0.1080 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -0.5160 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -1.9060 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -2.6630 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -2.0170 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -4.1240 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -4.6970 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 -3.8930 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8970 -2.5500 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 -4.4280 0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 -6.1990 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 -6.6830 1.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 -8.0540 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -8.9550 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 -10.3080 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 -10.7660 2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -9.8740 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -8.5170 2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -7.6380 3.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 -8.1840 5.2860 C 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 -2.3260 1.1870 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0720 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -2.5940 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -4.7330 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 -2.0270 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 -6.4860 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -6.6380 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 -6.0540 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -8.6000 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 -11.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 -11.8240 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6110 -10.2350 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 -7.3770 6.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 -8.7190 5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -8.8720 5.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END