PUBCHEM-ZINC00463407 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6990 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0640 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0520 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0830 -2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1840 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -5.0380 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -6.3440 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -7.5600 1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -8.8000 0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -10.0520 1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -11.0140 0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -10.3520 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -9.0340 -0.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -10.9990 -1.9740 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1450 -12.3130 -2.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -10.2610 -3.0640 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0790 -6.2600 -0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -7.1990 -1.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.9570 -1.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1580 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6030 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5800 -2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2820 -2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5030 -3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0270 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -4.7130 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -7.4890 2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -10.2250 2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -12.0840 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END