IFLAB-ZINC04263023 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5210 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0080 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.5020 0.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -1.8410 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -2.5700 0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -2.3980 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -3.7430 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -4.0380 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -2.9530 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -1.4780 0.0810 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.7240 -3.0080 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4700 -1.8290 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8480 -1.8880 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4910 -3.1120 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7570 -4.2840 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3780 -4.2400 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -4.7250 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -6.0250 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -6.3490 0.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -7.0490 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -8.3500 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -9.3790 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -10.7300 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -11.6880 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -11.3150 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -9.9810 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -9.0110 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8970 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.9070 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 1.8470 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -0.3350 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.3950 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -5.0500 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9700 -0.8730 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4270 -0.9760 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5700 -3.1520 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2650 -5.2370 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8070 -5.1560 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -4.4720 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -6.7610 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -8.6370 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -11.0220 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -12.7310 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -12.0700 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -9.6980 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -7.9710 0.2780 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 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 17 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 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 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 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 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M END