IFLAB-ZINC04275713 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.2500 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -1.8540 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -2.3340 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 -3.6620 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 -3.8730 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 -2.7440 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 -1.3540 0.0440 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -4.7510 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -4.4980 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 -6.0340 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -7.0610 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -8.4410 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -2.4740 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 -4.8510 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4850 -2.6860 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -6.9500 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -6.9590 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -9.2120 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -8.5520 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -8.5420 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 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 14 15 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 M END