PUBCHEM-ZINC03606312 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -1.8140 1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.6040 0.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -2.3130 2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -3.8200 2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 -4.4930 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -5.8740 1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -6.5860 2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -5.9090 3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -4.5270 3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -6.9800 4.1220 I 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -6.5930 1.3280 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6790 -5.9670 0.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -7.8110 1.3200 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 0.1420 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 -1.9360 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -1.9620 3.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -3.9380 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -3.9990 3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -7.9450 2.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -8.3370 3.3410 H 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 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END