IFLAB-ZINC04570838 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 0.0410 -2.0840 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7780 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0810 -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 0.0340 -4.1140 -2.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.5950 -3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -3.6890 -4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -2.0850 -4.0860 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -6.0760 -4.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -6.7130 -3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -8.1530 -3.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 -8.9250 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -8.4270 -2.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -10.4060 -3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 -11.0000 -2.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -12.3410 -2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -12.9840 -2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 -14.3470 -2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -15.0710 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -14.4320 -3.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 -13.0710 -3.6730 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 0.0540 -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 0.0010 -3.9030 -5.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -6.5270 -3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -6.2440 -5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -6.2630 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -6.5450 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -8.5510 -4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -10.8560 -3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 -10.5730 -4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 -12.4190 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5930 -14.8480 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -16.1360 -3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -15.0000 -4.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -12.5730 -4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 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 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END