IFLAB-ZINC05241179 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.7000 -0.6320 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -2.3800 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -2.9180 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -4.2880 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -5.1320 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -4.6030 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -3.2200 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -5.5040 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -5.0410 0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -6.8400 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 -7.6860 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -9.0520 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 -9.6930 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7260 -8.8090 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1120 -7.1660 0.0240 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.1890 -9.2030 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3980 -11.4600 0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 -11.1960 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6860 -11.0830 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -9.7940 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -10.1080 1.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -10.1270 -1.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -2.2630 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -4.7000 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -6.2020 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -2.8040 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -7.2100 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5960 -9.0780 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7420 -8.5760 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6410 -12.5080 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5170 -11.2240 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7790 -11.5900 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 -11.6750 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3310 -10.4390 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0080 -11.0540 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7500 -12.1060 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -9.8760 -2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -10.6180 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2980 -10.6130 -0.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 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 22 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 46 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M END