PUBCHEM-ZINC05965645 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -0.4320 2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -0.8990 3.7300 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1300 -0.9960 4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -1.4320 6.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -1.7730 5.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -1.6550 4.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -1.2150 3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -2.2440 7.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -2.5550 7.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 -3.0060 8.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 4.9150 0.0710 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0160 5.6260 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 7.0030 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 7.6430 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 6.8490 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 5.4780 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 9.1150 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 9.6880 0.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 11.0990 0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 1.5430 3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 1.3770 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -0.7180 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -0.8840 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -0.7300 4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -1.5080 6.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -1.9080 4.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -1.1250 2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -2.3290 8.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 -3.2140 8.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 5.1230 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 7.5790 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 7.3030 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 4.8560 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 9.7140 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 11.4340 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 46 1 0 0 0 0 M CHG 1 4 1 M CHG 1 15 1 M END