IBS-ZINC02216936 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8450 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -2.5720 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -2.4270 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 -3.8160 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 -4.3570 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 -3.5210 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -2.1320 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -1.5910 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7740 -4.1030 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9550 -3.3920 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9930 -4.3230 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4040 -5.5790 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0640 -5.4150 0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0840 -6.8090 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3690 -7.9970 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9380 -7.9710 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 -7.9500 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0800 -9.2820 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2970 -9.3050 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3850 -10.4370 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0940 -11.7190 0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.0080 -11.6320 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1920 -12.8100 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8580 -14.1700 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3810 -13.9420 -1.4490 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.6940 -14.4600 -1.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3370 -14.3670 -2.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4450 -12.1160 -1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -4.4620 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4250 -5.4300 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1200 -1.4850 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 -0.5180 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0580 -2.3160 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0510 -4.1090 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1640 -6.8290 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4150 -10.4190 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1980 -12.7610 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1230 -12.6820 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1370 -14.9840 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7200 -14.3460 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4470 -11.7710 -1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7140 -11.7020 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 3 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 M END