PUBCHEM-ZINC06042923 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 -0.0670 0.8310 1.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.5950 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -1.1070 0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -2.5420 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -3.1680 0.2010 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3060 -3.1670 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -2.3690 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 -2.1650 -2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -4.6410 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -5.3580 -0.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -5.8450 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 -5.7530 -2.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8860 -6.4710 -1.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4730 -5.7080 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5900 -6.7480 -2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9560 -7.3940 -2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8400 -8.6830 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1810 -8.4390 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -7.7490 -0.1880 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0970 -8.4440 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -7.5420 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 -6.3370 1.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 1.1760 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 1.5120 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 0.8970 2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.6320 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -1.2430 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -1.0690 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -0.4420 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -2.5710 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -3.1630 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6690 -2.8660 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -1.3860 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -1.5860 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -3.1160 -2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -1.6100 -2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -4.7220 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -5.1630 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 -5.5590 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7080 -5.8110 -2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -7.4030 -3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6300 -6.6970 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3990 -7.6040 -3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8360 -9.1160 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2550 -9.4180 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8510 -7.8260 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 -9.4030 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 -8.5920 1.9610 O 0 5 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 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 M CHG 1 48 -1 M END