PUBCHEM-ZINC05837042 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 0 0 0 0 0 0999 V2000 -0.7860 0.0250 -2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -1.1030 -2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -0.9470 -1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -1.9890 -2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3840 -1.7540 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 -1.1440 -0.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -0.6650 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -1.5250 1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 -1.0480 2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8070 0.2830 2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 1.1420 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 0.6730 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 1.5940 -0.4490 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0620 2.3690 -1.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 1.5770 -0.5160 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.9230 0.8000 3.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3950 1.2480 4.2210 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.5680 1.8590 2.3580 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.8410 -0.2280 3.2460 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -2.9510 1.4730 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6880 -3.7320 2.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -3.3430 0.8710 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2200 -0.2540 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 0.9370 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 0.1940 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -1.0560 -3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -2.0640 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 0.0530 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 -1.9000 -3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 -2.9880 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 -1.8430 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7550 -0.7550 -1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 -2.4960 -1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -2.1150 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -1.7160 2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4430 2.1810 1.2190 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 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 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 20 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 20 1 M CHG 1 22 -1 M END