PUBCHEM-ZINC05131986 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 0.0610 1.5240 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 0.0030 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6240 -0.4610 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -0.5360 -0.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9040 -0.2190 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -2.0640 0.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8530 -2.5510 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -2.6540 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3090 -3.3150 0.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -2.5270 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -2.1340 -2.2460 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8710 -2.3860 1.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 0.0450 0.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -0.2480 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -0.3280 1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -1.2470 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 1.9270 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 1.3850 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 1.8630 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 2.0250 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -3.0870 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 -2.8190 -1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 22 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 M CHG 1 11 -1 M END