IFLAB-ZINC04063173 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -0.7190 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -0.7180 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -0.0380 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -0.7390 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -2.1360 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 -2.8170 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -2.1090 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8440 -2.8910 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -4.1890 0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 -4.9060 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 -6.2890 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2100 -7.0250 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1260 -8.4280 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4200 -8.8830 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7020 -9.8120 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2380 -7.7920 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5250 -6.7030 0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 -9.0040 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -8.2740 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -6.9540 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -0.9020 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -1.6700 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -0.1170 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 1.0420 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 -0.2100 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -3.8970 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -2.6340 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -2.3640 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8770 -4.4320 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3170 -7.8270 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -8.7740 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 26 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 10 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 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 19 2 0 0 0 0 18 35 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 M END