PUBCHEM-ZINC06521570 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 -3.0360 0.3580 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -0.6500 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -1.2330 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -2.1990 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -2.5770 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -2.0280 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -1.0660 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.5110 -2.6490 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2010 -3.5820 -2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -2.3000 -2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -1.4590 -3.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -2.6550 -4.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -1.8540 -6.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -2.0820 -8.6080 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8220 -1.0040 -8.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -2.3210 -8.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3230 -2.8100 -7.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -2.9880 -8.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 -2.6200 -9.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 -2.0990 -10.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -1.9570 -10.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 -1.4070 -11.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 -1.6910 -11.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5930 -3.4940 -7.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -2.5600 -9.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -3.2200 -9.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -3.5190 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -2.8070 2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 1.0720 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -0.1480 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 0.9350 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.9320 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -0.6330 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -3.4680 -4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -3.1060 -5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 -1.4230 -5.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -1.0560 -6.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 -3.0430 -6.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2930 -2.7290 -9.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 -1.7680 -11.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8550 -0.6170 -11.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 -2.2470 -12.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0700 -1.8950 -11.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9260 -2.6620 -6.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4730 -3.9960 -7.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0700 -4.2250 -6.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 -3.3500 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -3.8940 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.5700 2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -2.4250 3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -3.0070 -1.9740 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6020 -1.7780 -3.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -1.0730 -4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -2.7430 -7.3160 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5140 -3.0790 -7.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -3.6280 -7.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -2.2290 -10.8950 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 52 1 0 0 0 0 10 11 2 0 0 0 0 10 51 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 52 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 14 54 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 24 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 57 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 52 53 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 M CHG 1 51 -1 M CHG 1 54 1 M CHG 1 57 -1 M END