NCID-ZINC05822620 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 0.0230 1.4340 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.0050 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -0.6320 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 0.1030 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -0.5540 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 -0.0960 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 -1.1860 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9360 -2.3300 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2700 -3.2400 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 -1.9610 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -2.6900 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -2.0280 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -2.7420 -0.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -3.1070 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -4.0510 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -4.6830 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1800 -1.1540 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7630 -0.0920 0.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8810 -2.3000 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2970 -3.6240 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4920 -4.5910 -0.3030 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5540 -5.0850 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7010 -3.7100 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2710 -2.4010 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2160 -1.3990 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5570 -1.7110 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9760 -3.0210 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0460 -4.0180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5520 -0.6410 0.6040 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.1970 0.5230 0.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.7260 -0.9250 0.7600 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.3720 -5.6290 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7040 -6.8350 0.6620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 1.8140 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 1.8020 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 1.7750 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 1.1820 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 0.9350 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.2070 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -3.7220 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -3.6710 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 -4.2920 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -4.4790 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -5.7590 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7680 -3.6430 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6220 -3.8870 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8960 -0.3740 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0270 -3.2630 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3710 -5.0410 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4110 -6.1370 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4430 -5.1300 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 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 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END