IFLAB-ZINC02694671 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -0.8320 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 0.0610 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -2.1210 0.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -1.0450 -1.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 0.0750 -2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 0.3750 -2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5990 1.5070 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7200 2.3620 -3.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 2.0580 -3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 0.9120 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 3.1450 -4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 3.4230 -4.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 4.5540 -5.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 5.4090 -5.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 5.1420 -5.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 4.0080 -4.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9110 3.5140 -4.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 -0.2830 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6550 1.7310 -2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 0.6780 -2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 2.7570 -4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 4.7740 -5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 6.2930 -6.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 5.8160 -5.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 M END