CHEMDIV-ZINC04712714 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 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 -3.9240 -8.9990 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -10.5280 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -11.0210 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -10.4910 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -8.9610 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -12.5510 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -13.0240 -2.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -14.5990 -2.6880 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -14.7490 -4.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -14.8780 -1.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -15.6090 -2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -15.9440 -3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 -16.7360 -3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7880 -17.1950 -2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 -16.8610 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 -16.0720 -1.3170 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 -1.9610 -8.8290 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -8.6480 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 -8.6380 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -10.8890 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9250 -10.9060 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -10.6610 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -10.8520 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -10.8420 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -8.6000 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -8.5830 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -12.9110 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 -12.9300 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 -12.4160 -3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 -15.5860 -4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9380 -16.9970 -4.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6690 -17.8140 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 -17.2190 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -15.8140 -0.4320 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 18 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 M END