PUBCHEM-ZINC05955088 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.0130 1.2910 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 2.1050 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -0.0470 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -0.5410 1.1050 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8570 -1.5070 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 0.4270 1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 0.3220 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.5470 0.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 2.4530 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -0.8890 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -0.9580 -1.6820 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5510 -1.1320 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -2.1460 -1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -2.3270 -1.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 0.3290 -3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4250 0.8860 -4.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2800 1.7450 -3.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8530 0.3470 -4.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2750 0.1520 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7190 1.1950 -2.0550 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.7830 2.1640 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0830 0.7450 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4890 1.3320 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8330 -0.5660 -0.8410 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9960 -1.1820 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3430 -0.9650 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1050 -2.0040 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 1.3130 -5.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 0.4570 -6.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -1.8980 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -0.5090 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 1.3550 -4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -0.2690 -4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5720 1.0380 -4.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9570 -0.6040 -4.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -3.0400 -2.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -3.7240 -2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 0.2980 -2.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 0.3470 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -0.2010 -4.0940 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 -0.5800 -5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 2.4350 -6.1220 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 8 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 38 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 16 40 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 26 2 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 28 29 2 0 0 0 0 28 42 1 0 0 0 0 36 37 1 0 0 0 0 38 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 4 1 M CHG 1 20 1 M CHG 1 42 -1 M END