PUBCHEM-ZINC06371838 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0400 0.8880 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.5170 0.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -1.4850 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.9000 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.1110 -2.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.6700 -3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 0.1430 -4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 1.5100 -4.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 1.7570 -6.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 0.5170 -6.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.4790 -5.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -1.7980 -6.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -2.4820 -4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -2.0080 -3.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 0.3340 -8.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1140 -0.6880 -8.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 0.6460 -8.9030 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0840 1.4460 -8.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 1.2860 -10.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9920 1.9590 -10.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 2.0100 -9.9080 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1480 2.9680 -9.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 1.2090 -8.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 2.2210 -11.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 2.9700 -10.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 2.5560 -9.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 0.2430 -11.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -0.4680 -10.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -0.4770 -9.1630 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8820 1.3990 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 1.3770 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 1.0210 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -1.1460 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -1.6280 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -2.4570 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -2.0000 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 2.3410 -4.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -3.5570 -5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 1.2710 -11.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 2.7770 -11.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 29 -1 M END