PUBCHEM-ZINC05842616 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.8450 1.6950 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 0.1920 -1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -0.4220 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -1.8020 -1.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -2.4530 -2.2040 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7510 -1.7730 -2.5430 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8870 -3.6670 -2.2000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5480 -2.5770 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -1.9780 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -0.5840 -1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 0.0050 -0.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 -2.8240 -0.6170 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6120 -3.8730 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 -2.6370 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3260 -2.4770 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1140 -2.3270 -2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4810 -2.1330 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8890 -2.0320 -3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9980 -2.1160 -5.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 -2.3080 -4.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 -2.4140 -3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 -2.6010 -2.9630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -2.6940 -3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7710 -2.4720 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 -3.0590 1.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8450 -2.8890 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 -4.5390 0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -5.0400 0.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 2.1230 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 2.0010 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 2.0480 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 0.1770 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -3.6540 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1830 -2.0650 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9380 -1.8820 -4.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3760 -2.0300 -6.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -2.3720 -5.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9790 -1.4500 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6670 -3.0820 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -2.4080 0.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -2.5830 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 -5.3020 0.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5120 -6.2460 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 40 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 40 1 0 0 0 0 27 28 2 0 0 0 0 27 42 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 5 1 M CHG 1 6 -1 M CHG 1 7 -1 M END