PUBCHEM-ZINC06272964 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.2500 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -1.8540 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 -2.3610 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 -3.8680 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -4.4580 -0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1470 -4.5550 0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -6.0040 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 -6.5980 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -6.8650 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3530 -7.4110 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9760 -7.6900 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3290 -7.4250 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 -6.8830 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3360 -8.2740 0.0470 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.9060 -8.5070 -1.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8860 -8.5200 1.1060 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 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 -0.8940 -2.4740 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -2.0100 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -2.0000 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 -6.3280 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -6.3370 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5960 -6.6460 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8580 -7.6180 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8160 -7.6430 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5510 -6.6790 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END