PUBCHEM-ZINC06007939 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.6110 1.3920 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 0.1490 -0.3180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9300 0.3170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -0.1760 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.2110 2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -0.5120 3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -0.7870 3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.7610 1.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -0.4590 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -1.0930 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -1.8850 -3.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5870 -2.9580 -3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -1.6040 -4.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -2.5160 -5.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -1.9610 -6.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -1.4490 -7.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -0.9330 -8.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -0.9420 -9.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -1.4700 -8.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -1.9790 -7.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -2.5050 -7.1380 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6540 -2.2210 -5.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -3.1810 -7.8870 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7580 -1.4690 -3.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -1.8430 -4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 1.2400 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 1.6770 -1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 2.2460 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 0.0010 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.5300 4.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 -1.0180 4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -0.9740 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -0.4430 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.0710 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 -1.5700 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 -1.7870 -4.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -0.5590 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -1.4610 -6.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 -0.5330 -9.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -0.5430 -10.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -1.4770 -9.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -1.0080 -1.2610 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8820 -0.9980 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -1.8890 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 42 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 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 42 1 M END