PUBCHEM-ZINC05797568 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.1410 -1.7740 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -2.7190 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -2.1690 -1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -1.4120 -1.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -0.8730 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -1.1180 -3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -1.9130 -3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -2.4610 -2.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -2.0430 -4.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -1.1810 -5.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -0.7050 -4.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -0.8940 -6.6330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -0.8390 -7.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.5810 -8.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -1.0780 -9.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -1.1840 -8.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -0.4690 -7.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -2.9500 -4.9730 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5970 -2.8420 -6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -4.4540 -4.6140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1490 -4.5210 -3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -4.9010 -4.4860 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8730 -5.7930 -3.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -3.6770 -3.8970 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2960 -3.6500 -2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -2.5100 -4.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -3.5600 -4.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -2.4180 -3.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -1.6940 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -5.2170 -5.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -5.4200 -6.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -5.1130 -5.6300 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0420 -0.1070 -2.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -0.7960 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -1.6170 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -2.1880 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -2.8810 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -3.6960 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 0.2100 -7.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -1.2880 -7.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -1.4570 -9.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -2.6550 -8.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -0.0340 -9.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -1.6610 -10.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -0.7560 -8.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -2.2430 -8.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -0.6180 -6.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 0.6130 -7.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -3.4150 -5.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4660 -4.4430 -3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 0.0270 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 0.2970 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 M CHG 1 32 -1 M END