IBS-ZINC06659865 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3700 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 1.2710 -0.5270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 0.7910 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 1.9550 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -1.9030 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 -2.3010 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -3.6450 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -4.6590 -0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 -3.5520 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 -4.5000 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1510 -4.0930 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4620 -2.7360 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4570 -1.7830 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -2.1800 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 -1.4800 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7620 -2.3430 -0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7510 -3.3750 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1240 -2.7540 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2440 -1.5470 -0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2190 -3.5390 -0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5640 -2.9480 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3500 -3.5330 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3350 -5.0600 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8920 -5.5640 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0900 -5.0030 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1360 -5.6380 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6640 -4.9040 -3.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.9360 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -0.6110 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 3.0230 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -2.6410 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6080 -5.5530 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9430 -4.8270 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7080 -0.7320 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6410 -3.9970 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6220 -3.9880 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4870 -1.8670 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0750 -3.1850 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8880 -3.2190 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3790 -3.1760 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7740 -5.3730 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4450 -5.2310 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8840 -6.6530 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4830 -5.4040 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0400 -5.2770 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2620 -6.9690 -2.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7850 -7.2920 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 31 1 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 16 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 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 47 48 1 0 0 0 0 M END