IBS-ZINC06664105 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -0.9500 -1.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1690 -0.0010 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 -1.5750 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6770 -2.6650 -2.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 -0.9220 -0.9560 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8920 -1.5300 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8900 -0.5900 -0.2940 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5820 -0.4020 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2970 -1.2170 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1640 -0.1810 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3270 1.1150 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9610 0.6510 -1.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -1.8500 -2.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -1.4260 -3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -0.3090 -3.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -2.3510 -3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -1.9890 -4.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.8920 -5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -4.1520 -4.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -4.5230 -3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -3.6290 -3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -3.9630 -2.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -4.8410 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -3.0830 -1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -3.4160 -0.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4290 -0.0500 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8650 -2.4790 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1990 -1.7030 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6680 -1.3540 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2840 -2.1670 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1400 -0.0710 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2690 -0.4550 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5060 1.5760 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5540 1.8140 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -1.0080 -5.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -2.6150 -6.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -4.8490 -5.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -5.5070 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 M END