PUBCHEM-ZINC03679994 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 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 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5530 -1.8510 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -2.4130 1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 -2.8940 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 -4.2380 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4730 -4.6790 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5050 -3.7750 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2270 -2.4300 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 -1.9890 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9080 -4.2470 1.4090 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.1530 -5.4320 1.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8180 -3.4510 1.2620 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 -2.8570 -3.0680 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 -1.3960 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 -4.9450 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6900 -5.7300 1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0340 -1.7240 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 -0.9380 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -3.8570 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -3.8210 -0.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -4.3830 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 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 21 1 0 0 0 0 2 22 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 8 1 0 0 0 0 6 30 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END