IFLAB-ZINC04032890 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 -2.5580 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -3.9060 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -4.4520 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3570 -5.8200 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -6.6570 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -6.1040 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -4.7360 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -8.1230 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 -8.6030 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -8.9290 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -10.3840 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -11.0600 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -12.5570 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -13.2340 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -14.6850 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -15.4360 -2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -16.7890 -2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -17.4310 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -16.7070 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -15.3280 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -14.5820 1.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -15.0260 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -13.2490 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -12.6210 2.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -18.7790 -1.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -19.4690 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0540 -3.8040 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3500 -6.2440 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -6.7480 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -4.3070 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -8.5460 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -10.6890 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -10.6800 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -10.7550 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -10.7640 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -12.7110 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -14.9460 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -17.3680 -3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -17.2110 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -19.0940 -2.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -19.3030 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -20.5360 -2.1460 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 43 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 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 49 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 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END