IFLAB-ZINC04195556 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.0000 1.5140 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0160 -0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7390 -0.5200 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -0.2330 1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -0.1880 2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 0.0720 2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 0.2880 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 0.2460 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 -0.0140 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -0.0530 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.3000 -2.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.5020 -1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.8140 1.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -0.6600 -1.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -1.2390 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -2.1240 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 -2.6960 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 -2.3930 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 -1.5160 -2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -0.9250 -2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 0.0180 -3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 0.4560 -3.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 1.8820 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.8730 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.8780 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -0.0190 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -1.5940 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 -0.3550 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 0.1080 3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 0.4890 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 0.4140 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -0.3550 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 -2.3660 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -3.3850 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8610 -2.8460 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2450 -1.2840 -2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 0.3930 -4.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 1.0130 -4.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 38 39 1 0 0 0 0 M END