PUBCHEM-ZINC00195227 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 0.5640 0.9820 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -0.4380 -0.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -0.9400 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -0.0840 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -0.5880 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -1.9550 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -2.8140 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -2.3070 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -4.2810 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -5.0510 -0.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 -4.7490 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -5.9220 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 -6.4230 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4350 -6.2100 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7130 -6.6830 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0210 -7.3670 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0500 -7.5810 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 -7.1200 2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3960 -7.8710 1.6060 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.2530 -7.6840 0.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6700 -8.4730 2.6280 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.0280 -3.8190 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 -2.4530 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 1.2490 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 1.4430 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 1.3380 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 0.9830 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 0.0880 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -2.9780 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -6.4910 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1960 -5.6760 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4760 -6.5200 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2980 -8.1150 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 -7.2930 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -3.7190 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9640 -4.2210 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 -2.5290 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 -1.7370 0.0100 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END