IFLAB-ZINC04942080 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.0340 1.5410 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 0.0120 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -0.4930 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -0.8030 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -1.2470 2.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -1.4180 3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -1.1250 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.6470 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -0.2600 2.5790 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -1.8660 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 -1.7720 2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -0.7230 2.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 -2.8540 1.9630 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 -2.7950 2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7120 -1.6190 1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0830 -1.5620 1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7790 -2.6780 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0980 -3.8530 2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7280 -3.9140 2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1280 -2.6200 2.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7810 -3.8070 3.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -1.3280 4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -1.0880 5.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -1.7870 5.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -2.0530 5.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 -2.4640 6.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -1.8840 4.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -2.1970 4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -1.9980 7.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 1.9200 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.9060 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.8880 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -0.3670 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -0.3350 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -0.6790 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -2.1500 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -2.6160 2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 -3.6740 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1700 -0.7500 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6130 -0.6470 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6400 -4.7210 3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1990 -4.8300 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6010 -4.6160 2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3860 -4.0840 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8520 -3.6250 3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 -1.3080 4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 -2.9940 4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 -2.5210 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -3.0170 7.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -1.8430 7.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -1.2930 7.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 M END