IFLAB-ZINC04553605 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 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 -0.7010 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7780 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0820 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.8190 -2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -2.2090 -3.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -4.1660 -2.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -4.8970 -3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -6.4010 -3.4800 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8220 -6.6780 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -7.1530 -4.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -8.0220 -5.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -8.5900 -6.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -8.1830 -7.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -7.0120 -6.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -6.8200 -2.5430 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -6.5400 -3.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -6.3780 -1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -8.5780 -2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -9.3450 -3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -10.7240 -3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -11.3370 -2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -10.5670 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -9.1880 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -12.6850 -2.1560 F 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 -0.1620 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6220 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.6530 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -4.6450 -4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -4.6200 -4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -8.2640 -4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -9.3100 -6.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -8.5180 -8.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -8.8670 -4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -11.3230 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -11.0440 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -8.5880 -0.5910 H 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 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 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 M END