IBS-ZINC01239338 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 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 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -5.2700 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 -6.6660 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 -6.6850 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -5.2890 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4370 -8.0520 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 -8.0380 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5010 -7.0750 1.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2420 -9.0960 1.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1660 -9.0840 2.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9470 -10.1020 2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8600 -11.2990 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9200 -10.0890 3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0120 -8.9830 4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9410 -9.0210 5.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7430 -10.1390 5.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6350 -11.1670 4.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7700 -11.1770 3.8960 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 -3.0230 -4.5190 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -5.2090 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -6.8090 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -7.4200 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -7.4380 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 -6.8410 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -5.2410 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -4.5400 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -8.8890 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -8.1580 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1860 -9.8660 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1370 -12.0100 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8380 -11.7760 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5410 -10.9780 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3730 -8.1230 4.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0400 -8.1870 6.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4690 -10.1710 6.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7150 -12.0350 3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -6.7930 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 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 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 54 1 0 0 0 0 15 42 1 0 0 0 0 15 43 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 16 54 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 46 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 28 53 1 0 0 0 0 M END