PUBCHEM-ZINC05489951 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -4.9090 -0.3830 -5.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 -0.6680 -4.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 -1.6700 -5.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -2.4190 -6.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 -3.4300 -7.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -3.6830 -6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -2.9270 -5.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -1.9140 -5.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -3.4250 -5.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -3.1240 -4.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -4.4450 -6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -4.6080 -7.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -5.2610 -6.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -6.4460 -7.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -7.3190 -7.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -7.0300 -6.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -5.8700 -6.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -4.9670 -5.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -3.7460 -5.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -3.2220 -4.3720 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.9380 -0.0330 -6.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5590 -1.2520 -5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2850 0.4240 -4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4440 -2.2460 -6.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 -4.0120 -8.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -1.3390 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -6.6970 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -8.2170 -8.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 -7.6960 -6.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -5.6540 -5.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 -3.3350 -5.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 31 2 0 0 0 0 M CHG 1 20 -1 M END