PUBCHEM-ZINC04562369 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 -0.1520 1.2520 1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -0.1300 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -0.8340 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -0.1600 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 1.2310 0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 1.9330 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -0.9240 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 -1.0230 -0.9580 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1830 -0.0260 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -1.8160 -0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 -3.0340 -1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -1.0560 -0.7560 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 -1.6590 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 -0.6360 -0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1460 -0.3540 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0970 0.6220 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7210 1.3300 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3910 1.0660 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4400 0.0900 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 -1.7460 -1.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -1.1090 -2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 0.1050 -2.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -2.0750 -3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -1.3410 -4.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -2.3090 -4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -1.5460 -5.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -2.4950 -5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 1.8000 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -0.6610 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -1.9130 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 1.7780 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 3.0110 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -0.4420 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -1.9330 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 -0.0550 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 -2.4630 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9600 -2.1290 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 -0.8930 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3480 0.8330 2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4600 2.0910 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8710 1.6230 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1880 -0.0990 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -2.7610 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -2.6630 -4.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -2.7630 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -0.7020 -3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -0.6740 -4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -2.9350 -5.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -2.9790 -3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -0.9090 -4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -0.8800 -6.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -3.1030 -6.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -3.1430 -5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 -1.6950 -6.5760 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8610 -2.3000 -7.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 -1.0740 -7.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -1.1050 -5.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 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 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 54 57 1 0 0 0 0 M CHG 1 54 1 M END