PUBCHEM-ZINC06863098 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -2.1200 1.3240 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -0.0540 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.7840 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 -0.1100 -2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 1.2680 -2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 1.9840 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0410 1.9840 -2.9610 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.8550 1.3560 -3.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0750 3.2020 -2.9550 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.9540 -2.2560 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -2.9020 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -4.3650 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -4.9980 -1.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -5.0120 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -6.4020 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -7.1090 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -8.4890 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -9.1730 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -8.4580 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -7.0780 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 -9.4770 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 -9.2540 0.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 -10.6930 0.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -10.5980 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -11.5310 0.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -11.9540 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -12.4820 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -13.7790 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 -14.2340 0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 1.8900 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -0.5680 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -0.6670 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 3.0640 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -2.8170 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -2.3410 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -4.5090 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -6.5780 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -9.0340 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -6.5260 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -12.6840 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -11.7850 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 -11.7510 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -12.6500 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 -14.4280 -2.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3010 -15.2560 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END