IBS-ZINC06669673 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 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 0.7430 -0.5120 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -0.2100 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 0.0960 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 0.3890 0.0010 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 0.0990 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 -0.2140 2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.5030 3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 -0.7830 4.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -0.4370 4.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3150 -0.1300 3.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2510 -0.0950 4.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 0.1420 2.5530 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 0.4700 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1170 1.9600 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 2.5250 3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8210 3.8920 3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5040 4.6940 2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9940 4.1290 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8050 2.7610 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -0.7120 5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 -2.1830 6.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 -2.9260 5.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 0.1700 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -0.4660 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0110 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 0.3670 -0.0030 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -1.5880 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 -0.0350 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 0.1410 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 1.8990 4.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2190 4.3340 4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6540 5.7620 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7460 4.7550 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4100 2.3200 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -0.1410 6.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -0.4230 6.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 1.2130 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -0.3440 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1830 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -2.6690 7.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 -3.6190 7.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 47 48 1 0 0 0 0 M END