PUBCHEM-ZINC02548305 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0720 1.5140 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.0070 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.4250 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -0.5820 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -0.6450 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -1.3520 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 -1.4690 -2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 -2.1420 -2.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 -2.3050 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3260 -2.7450 -3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9410 -3.0490 -2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2640 -3.4800 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0130 -3.6180 -3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3960 -3.3090 -4.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0780 -2.8750 -4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5820 -2.5970 -5.7770 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3160 -2.1710 -5.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 -2.0040 -4.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4480 -4.0820 -3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0610 -4.1790 -4.3130 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9140 1.9660 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 1.8320 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 1.9220 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -0.4100 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.0710 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -1.5170 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -0.0350 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 0.3650 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -1.2040 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -2.3480 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -0.8110 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0330 -0.4650 -3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -2.0310 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 -2.5240 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4050 -2.9480 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7150 -3.7060 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9730 -3.4090 -5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 -1.9360 -6.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9300 -4.3400 -2.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 2 0 0 0 0 M CHG 1 20 -1 M END