PUBCHEM-ZINC06403172 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 31 0 0 1 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8440 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -2.5710 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -2.3760 0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -3.8300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4210 -4.1680 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 -5.6870 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 -6.0240 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2730 -7.5430 0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7390 -7.9690 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7390 -7.8750 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3660 -8.1800 0.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 -8.1050 1.2690 N 0 5 0 0 0 0 0 0 0 0 0 0 -6.2170 -7.7260 2.0710 H 0 0 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -1.7950 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -4.2470 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -4.2560 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 -3.7510 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8970 -3.7420 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 -6.1030 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1250 -6.1130 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5530 -5.6070 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -5.5980 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3480 -7.8320 -1.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2890 -8.0520 -1.3070 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 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 15 16 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 15 -1 M END