CHEMDIV-ZINC06808140 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.4240 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0050 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -0.6340 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 0.0150 -0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -2.0460 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -2.7940 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -4.1530 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -4.5330 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -3.1140 -0.0610 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -5.9310 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -6.2050 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -7.5120 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -8.5510 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -8.2870 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -6.9840 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -2.2230 0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 -3.0060 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -4.2160 -0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -2.3960 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8370 -2.1210 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0910 -1.5490 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6220 -1.2470 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9060 -1.5150 -1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6480 -2.0820 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 -2.3380 -2.5420 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.3200 -2.4160 2.2080 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.8010 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 1.7550 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.8040 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 -4.8650 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -5.3950 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -7.7250 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -9.5730 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -9.1020 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -6.7790 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -1.2610 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6580 -1.3370 1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6030 -0.8000 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3280 -1.2760 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 M END