PUBCHEM-ZINC02046989 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 1.7950 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 2.2560 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 2.4880 -3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 2.2560 -3.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 1.8230 -2.3220 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6970 2.9880 -4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 3.1460 -5.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 3.6650 -7.2020 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 4.9640 -7.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 2.4980 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9690 4.1540 -1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6470 3.2090 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 3.9350 -3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2040 5.5810 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 6.2090 -1.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 1.5530 -0.0090 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 2.4340 -4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 2.2690 -5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 3.9480 -4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 2.3300 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 1.8120 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 2.1770 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2290 3.3650 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7180 3.4100 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6280 4.1370 -3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0740 4.6090 -3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 2.9030 -3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.6720 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 3.8450 -8.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 2.5900 -7.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 3.8820 -1.8630 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 4.0820 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3920 6.1540 -0.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 7.0710 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 1.7130 -8.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 4.1560 -8.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 34 41 1 0 0 0 0 35 40 1 0 0 0 0 36 37 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 7 1 M CHG 1 18 -1 M END