IBS-ZINC05529729 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.1970 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0110 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 1.8530 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 0.6890 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -0.4050 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 -1.3310 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9570 0.8300 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4750 2.0530 -0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 3.1240 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 3.0410 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7800 -0.2860 -0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1970 0.1050 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0700 -1.1500 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3420 -2.4130 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4690 -1.1580 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6310 -3.2040 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4530 -3.9540 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9110 -3.1350 -3.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 4.1000 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4160 0.6520 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 0.7390 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1220 -0.8650 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8710 -1.6830 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1230 -2.9600 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1330 -3.0480 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 -1.4440 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 -0.6250 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3650 -3.8610 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 -2.8900 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0320 -4.8770 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3990 -4.1900 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8280 -3.5470 -4.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7590 -2.0220 -1.1460 N 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 14 2 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 41 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END