IFLAB-ZINC04272083 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 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 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -4.7830 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -6.1120 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -6.8870 -0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -6.6290 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 -5.8530 0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 -8.0700 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -9.0750 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -10.2730 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 -10.1210 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 -8.7450 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8160 -8.2970 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8480 -9.2110 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5770 -10.5710 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -11.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -11.5630 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -12.0560 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 -11.3950 -2.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -13.2310 -1.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -13.8280 -3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -15.1780 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -15.5300 -1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -14.1280 -0.7090 C 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 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -4.1640 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -8.9220 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0290 -7.2380 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8710 -8.8670 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3920 -11.2790 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 -12.0890 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -11.4430 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -12.2850 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -13.9900 -3.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -13.1710 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -15.9340 -3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -15.0670 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -15.9950 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -16.1710 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -13.8220 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -14.1310 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 23 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 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END