IFLAB-ZINC04315608 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4300 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.6840 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -2.0310 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1910 -2.2770 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 -1.1410 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 -0.1160 -0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 0.8320 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6070 -0.9740 -0.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0890 -2.7190 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6150 -2.8260 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0050 -4.2380 -0.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3090 -4.5760 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1600 -3.7120 -0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7110 -6.0290 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1360 -6.1290 -0.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6670 -7.3800 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0430 -7.5510 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5800 -8.8240 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7460 -9.9270 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3740 -9.7600 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8320 -8.4890 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9890 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 -2.7740 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 -3.2110 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6820 -3.2000 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0050 -2.3340 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0220 -2.3440 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3240 -4.9290 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3200 -6.5210 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3040 -6.5110 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6950 -6.6900 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6520 -8.9580 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1680 -10.9220 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7250 -10.6230 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7600 -8.3580 -0.1450 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 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 26 44 1 0 0 0 0 M END