IFLAB-ZINC04323080 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 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 -0.7010 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 0 0 0 0 0 0 0 0 0 0 0.0560 -7.3060 -5.0520 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -7.1470 -5.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -7.1120 -5.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -8.9020 -4.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -9.6470 -4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -10.9420 -5.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -11.6760 -4.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -10.9080 -5.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -9.6130 -4.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -12.9380 -5.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -13.0520 -6.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -14.3000 -7.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -15.4380 -6.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -15.3300 -5.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -14.0840 -4.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -13.9780 -3.3440 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 0.9570 -6.6530 -2.9170 H 0 0 0 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 -1.2740 -9.8860 -3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -9.0450 -4.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -11.5590 -4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -10.7020 -6.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -11.4990 -5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -10.6680 -6.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -8.9880 -4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -9.8480 -3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -12.1640 -7.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -14.3880 -8.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -16.4120 -7.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -16.2210 -4.6780 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 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 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 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 M END