IFLAB-ZINC04346931 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 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 -0.7310 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.4330 0.6660 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0020 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7120 -1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.9030 -2.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -4.2280 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.6340 -0.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -5.2060 -2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.8990 -2.3010 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -7.8840 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -9.2880 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -10.0570 -4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -9.4320 -6.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -9.8860 -7.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -8.8940 -8.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -7.7550 -7.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -8.0620 -6.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -7.2990 -4.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -6.3980 -8.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -6.2090 -9.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -4.9180 -9.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -3.8660 -9.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -4.0730 -7.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -5.2820 -7.2380 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 0.0270 -0.3440 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.5780 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -5.0620 -3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -5.0380 -3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -9.7550 -2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -11.1350 -4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -7.0500 -10.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -4.7350 -10.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -2.8570 -9.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -5.4110 -6.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 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 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 20 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 26 39 1 0 0 0 0 M END