PUBCHEM-ZINC05759308 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -1.9570 -0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 -2.5860 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -1.9400 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -3.9920 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8710 -4.6240 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -6.0330 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0750 -6.8010 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 -8.1340 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -8.1290 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 -6.8650 -0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -9.3260 -0.7180 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9540 -10.4320 -0.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -9.2050 -0.7560 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -4.5640 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -4.0520 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 -6.4460 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 -9.0030 -0.5750 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 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 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 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END