PUBCHEM-ZINC04114012 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.4440 1.4590 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 0.0110 -0.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -0.5680 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -0.9160 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -1.5950 3.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -2.0210 3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -1.4220 3.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -0.7670 -1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -0.1950 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -0.9710 -3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -2.3610 -3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -2.9570 -2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -2.1730 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -3.1090 -4.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -3.9380 -4.9460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -4.6610 -6.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -5.5750 -6.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -6.3000 -7.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -6.1140 -8.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -5.2180 -8.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -4.5000 -7.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -6.8670 -9.7980 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6450 -7.6520 -9.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -6.6740 -10.6200 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4130 1.9270 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 1.7230 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.9050 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -1.4380 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 0.1550 1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 0.0000 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -1.5720 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -2.4850 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -0.9190 3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 0.8840 -2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 -0.4800 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -4.0390 -2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -2.7030 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -5.7190 -5.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -6.9950 -7.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -5.0660 -9.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -3.8050 -6.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -2.9270 4.7220 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 15 16 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 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 42 -1 M END