IFLAB-ZINC00213922 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 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 -0.1270 -0.4320 2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -0.8990 3.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -2.2500 4.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -2.7160 5.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -4.0990 5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -4.2720 6.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -5.1170 7.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -3.0400 7.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -2.1280 6.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -4.9100 4.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -4.4290 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -3.1370 3.2310 N 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 -1.7350 3.4490 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 3.5670 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 3.9580 -0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 4.2300 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 4.1120 -2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 3.7260 -1.1570 C 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 -0.4810 1.5430 3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 1.3770 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -0.7180 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -0.8840 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -0.2620 4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -2.8480 7.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -5.1150 2.8260 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 -3.5020 3.3550 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 4.0490 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 4.5340 -2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 4.3250 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 3.6380 -1.3300 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 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 39 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 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 M END