CHEMDIV-ZINC05057961 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -4.8060 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -6.2710 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -6.9610 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -6.3700 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -8.4680 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -9.0970 -0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 -8.7090 1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9610 -10.8960 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3060 -11.5750 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0250 -11.9260 -1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1590 -12.5030 -0.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 -12.4980 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9980 -11.9420 1.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1700 -13.0350 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0100 -12.9690 2.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9920 -13.4720 3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1320 -14.0410 3.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2960 -14.1100 1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3250 -13.6050 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5400 -14.7330 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6340 -11.7130 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -4.4550 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -4.4450 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -6.7440 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -8.8190 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -8.8290 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -11.1870 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -11.1960 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1210 -12.5250 3.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8700 -13.4210 4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8970 -14.4340 3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4560 -13.6550 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3040 -13.9660 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3070 -15.1820 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9100 -15.5020 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 -12.5790 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5310 -11.5840 -3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 -10.8220 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 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 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 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 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 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 29 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END