PUBCHEM-ZINC03591045 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 32 0 0 1 0 0 0 0 0999 V2000 0.0410 1.4900 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.0360 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -0.6110 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -2.1450 0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7920 -2.5270 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -2.6560 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -4.1770 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -4.6930 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 -3.8420 0.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 2.0540 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 3.5750 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 4.2110 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 3.4210 -0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 1.9080 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 1.7920 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -0.3230 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -0.4540 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -0.2300 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -0.2390 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 -2.2050 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -2.3120 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 -4.6550 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -4.5290 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 1.6280 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 1.7460 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 4.0020 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 3.8820 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 -5.9270 0.7700 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7880 -2.6850 -1.2140 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8270 -3.7120 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -2.4220 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -2.3320 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 5.4680 0.0950 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 29 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 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 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 29 1 M CHG 1 33 -1 M END