IFLAB-ZINC04032824 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 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 -0.6970 1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0630 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7700 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2340 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.8640 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -4.1160 -2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -4.7030 -3.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.7720 -2.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -2.2880 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0700 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6800 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -6.3700 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -6.8950 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -8.3590 -1.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -9.0450 -1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5430 -8.4500 -1.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -10.5500 -1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 -11.0670 -1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 -11.2890 -2.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8040 -11.7660 -2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -11.9320 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -11.4780 -0.4110 S 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 -0.1520 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.5950 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -4.7980 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1310 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -6.6930 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -6.7620 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -6.5720 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 -6.5030 -2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -8.8350 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -10.8740 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 -10.9420 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -11.1090 -3.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4300 -11.9870 -3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1950 -12.2940 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 13 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 12 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 14 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 12 1 0 0 0 0 12 13 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 M END