PUBCHEM-ZINC05882086 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -0.6930 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -1.2210 -1.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9240 -0.5650 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 -1.3910 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 -2.6160 -2.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7920 -3.3680 -2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -4.4230 -2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 -4.3260 -1.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 -3.2410 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -2.5680 -0.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9580 -5.5060 -2.2760 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.7110 -5.4870 -3.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0240 -6.4150 -1.4680 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 -1.9080 0.2560 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -1.4140 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6220 -0.5410 -2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 -1.5300 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 -3.1540 -3.8120 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 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 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