IFLAB-ZINC00148423 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 1.8130 -2.1910 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -0.7890 1.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7630 -0.8070 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 0.1020 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -0.0530 -1.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -0.1820 1.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -0.5410 2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -1.3430 3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -1.6550 4.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -1.1670 4.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -0.3260 3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -0.0210 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -1.5620 6.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -1.6640 7.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 -1.8160 5.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 -2.1540 6.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1770 -2.2680 8.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 -2.6030 8.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5080 -2.8250 8.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7290 -2.7120 7.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6740 -2.3760 6.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 -2.2330 4.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0530 -2.4540 4.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -2.2000 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -2.5920 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -2.8830 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -1.7490 3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -2.2920 5.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 0.1080 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 0.6240 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 -1.7760 4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 -2.1000 8.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -2.6910 10.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3300 -3.0860 9.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7340 -2.8920 6.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7860 -1.7300 4.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9580 -2.3040 3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3900 -3.4820 4.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 0.8840 0.3280 O 0 5 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 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 30 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 31 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 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M CHG 1 39 -1 M END