PUBCHEM-ZINC03678794 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 0.5300 1.3580 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -0.0890 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -1.0130 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -0.5220 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -1.8320 -0.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -2.4310 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -1.8160 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 -2.5030 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 -3.8200 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 -4.4350 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 -3.7530 -0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -4.2830 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -5.6210 -1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3060 -4.5640 0.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1590 -5.6120 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 -4.5490 1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3150 -4.3480 1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5230 -4.4380 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6490 -4.3180 3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4930 -4.4730 5.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2420 -4.7440 5.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1110 -4.8680 5.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2800 -4.7090 3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3530 -4.7780 2.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3680 -4.9680 2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2890 -4.0830 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7130 -4.5110 -0.7620 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.6520 -5.6010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5480 -3.9550 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0730 -3.2400 -2.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8350 -4.3800 -1.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6840 -3.9100 -2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 1.6820 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 2.0310 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 1.4770 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.1600 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -2.0450 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -0.6950 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -1.0100 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -0.5190 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 0.1790 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -0.7980 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 -1.9900 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -5.4520 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -6.3210 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -5.7210 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -5.8720 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6310 -4.1070 3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3590 -4.3800 5.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1430 -4.8630 6.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 -5.0800 5.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2240 -4.6230 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5330 -3.0130 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7340 -2.8160 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3270 -4.2720 -3.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6880 -4.3060 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2670 -4.0060 -0.8930 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.2760 -2.9800 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9230 -4.1920 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 57 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 57 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 M CHG 1 57 1 M END