IBS-ZINC01468985 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.2220 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 0.0360 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4200 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 2.1260 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -2.1600 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -2.8270 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -4.2280 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -4.9210 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -4.3310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -6.3920 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -7.2380 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -8.5380 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -8.4270 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -7.1920 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -6.8740 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 -9.8060 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 -9.7770 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 -10.9560 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -12.1720 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 -12.2070 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -11.0280 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -13.5110 0.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -14.2850 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 -13.4540 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9010 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 3.3640 -0.4840 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 2.3340 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -2.6840 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -4.6990 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 -6.9600 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -8.8310 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -10.9300 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -11.0530 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -14.4620 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -15.2290 0.2340 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 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 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M END