PUBCHEM-ZINC05633360 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.6540 -0.0010 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -0.8660 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -1.4780 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -0.1080 1.6180 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3540 -0.7530 1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 1.2140 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 2.2650 1.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 0.1870 2.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -0.7370 3.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -1.9350 3.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.1430 5.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -1.2080 6.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -1.0020 7.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 0.0860 7.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -2.1680 7.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -2.2230 9.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -3.3460 10.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -3.4720 11.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -3.6530 11.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -2.5400 10.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 -2.4090 9.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 0.8300 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -0.6000 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 0.4130 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -1.7060 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -0.7160 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -2.0720 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -2.1440 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 1.1830 3.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 0.6020 5.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 0.3210 4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -2.1310 5.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -3.0180 7.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -1.2650 9.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -4.3010 9.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -3.1600 10.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -4.3230 12.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -2.5750 12.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 -4.6220 10.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8730 -3.6720 12.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 -2.7380 10.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -1.5880 10.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -1.5630 8.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -3.3040 8.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 1.0880 0.0700 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 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 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 45 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 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 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 M CHG 1 45 -1 M END