IFLAB-ZINC04940687 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0340 1.3040 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -0.0460 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.2920 -0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -0.9790 1.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -2.1960 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -2.7810 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -3.9820 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -4.6070 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -4.0280 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -2.8240 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -4.6610 -0.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -6.0060 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 -6.6700 -0.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -6.6850 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9730 -8.2030 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2790 -8.8630 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0820 -9.1650 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7640 -8.8950 -2.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3580 -9.8330 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3760 -10.2590 -1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5030 -10.8720 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6580 -11.0820 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6630 -10.6680 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5410 -10.0580 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 -9.4010 1.3290 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 -10.4930 1.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4490 -8.2560 2.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 1.9190 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 1.7900 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 1.1780 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -0.8070 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -2.2950 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -4.4340 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -5.5460 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 -2.3730 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 -4.1310 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 -6.3730 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7590 -6.4080 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -8.5150 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 -8.4800 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2730 -10.1040 -2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2780 -11.1940 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5470 -11.5640 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7740 -10.8270 2.1430 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 25 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 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 M END