IFLAB-ZINC04519497 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 0.9570 -6.6530 -2.9170 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 1.0090 -7.9950 -5.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -8.5700 -6.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -8.1960 -7.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -7.0590 -6.0080 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -6.8620 -2.5150 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -6.3180 -1.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -6.7240 -3.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -8.6000 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -9.0860 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -10.4490 -0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -11.3270 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -10.8420 -3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -9.4780 -3.1910 C 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 1.8840 -8.2110 -4.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -9.2700 -6.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -8.5400 -8.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -8.4000 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -10.8280 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -12.3930 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -11.5280 -3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -9.0990 -4.0550 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 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 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 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 38 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 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 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 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