IFLAB-ZINC04315622 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 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 12.1620 -3.7100 -0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7030 -5.9990 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7240 -6.9960 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0930 -8.3240 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4360 -8.6760 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4180 -7.6850 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0540 -6.3520 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6440 -8.2860 -0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4000 -9.6420 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0480 -9.8940 -0.1760 O 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 9.6780 -6.7260 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3350 -9.0930 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8140 -5.5840 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4840 -9.7300 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0900 -10.3260 -0.1060 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 30 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 31 1 0 0 0 0 6 32 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 33 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 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 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 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 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 41 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END