PUBCHEM-ZINC06007597 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.1400 1.5780 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 0.0570 0.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4750 -0.3130 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -0.6560 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -1.8700 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -2.5690 2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -2.0700 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -0.8740 3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -0.1740 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 0.0770 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -0.8520 -1.4540 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1470 -0.5510 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 -0.9140 -2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0570 -1.7610 -2.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7600 -1.9010 -4.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9360 -2.6530 -3.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7570 -2.8750 -5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3900 -2.3390 -6.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2140 -1.5910 -6.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4010 -1.3750 -5.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2450 -2.5620 -7.4260 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.2790 -3.2260 -7.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8820 -2.0690 -8.5040 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.9090 -2.1550 -1.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 -2.7800 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 1.8560 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 2.0280 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 2.0370 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -2.2880 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -3.5040 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -2.6120 4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -0.4870 4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 0.7520 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.1100 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 1.1340 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 0.0940 -3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -1.3520 -3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2210 -3.0670 -2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6650 -3.4600 -4.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9130 -1.1690 -7.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 -0.7940 -5.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -0.2890 -0.0450 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5740 -1.3250 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 0.0510 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 42 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 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 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 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 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 42 1 M END