IFLAB-ZINC04138065 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.1000 1.5000 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.0050 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.6990 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -2.0770 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.7720 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -2.0660 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.6880 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 0.0620 -2.4640 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9390 -0.3840 -3.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 1.1260 -2.6080 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1400 -4.2490 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.8510 -1.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -4.9280 1.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -6.3910 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -6.9000 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -7.1840 3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -7.6490 4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -7.8380 5.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -7.5500 4.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 -7.0840 3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -7.8480 5.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -8.2760 6.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -8.2770 6.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -8.5470 7.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2950 -8.6950 7.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 1.9070 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 1.8420 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 1.8410 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -0.1600 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -2.6180 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.5980 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -4.4470 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -6.7900 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -6.7140 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -7.0380 2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -7.8660 5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -6.8650 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -7.7430 4.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 -7.8290 8.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -9.4530 8.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -9.1050 7.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 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 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END