CHEMDIV-ZINC00070684 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 0.5320 1.6350 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 0.1440 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -0.6880 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -2.0780 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -2.6680 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -1.8270 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -0.4360 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -4.1210 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -4.8090 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -6.4920 -1.0710 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -6.2020 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -4.9200 0.8860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -7.1570 1.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -8.5490 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -9.3520 2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -10.7470 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -11.3790 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -10.5800 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -9.1920 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -11.1720 -0.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -12.8700 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -13.2570 0.2060 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5590 2.0070 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 2.1160 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 1.9310 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.2620 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -2.7020 2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -2.2320 -2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 0.1930 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -4.4360 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -6.8070 2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -8.8940 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -11.3380 3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -8.6370 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -12.1680 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -13.5910 2.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 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 31 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 2 0 0 0 0 M CHG 1 22 -1 M END