PUBCHEM-ZINC01284290 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 0.4200 2.1020 4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 1.8400 2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 0.3980 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 0.0400 2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -1.2840 2.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -2.2540 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -1.9030 2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.5750 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -0.2170 2.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -0.4950 3.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -0.9840 4.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 -0.1990 3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0170 -0.5790 4.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 -0.3770 5.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1220 0.1760 4.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4730 0.3800 4.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0520 0.0340 5.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2810 -0.5180 6.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 -0.7290 6.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0920 -1.3350 7.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5000 0.2540 5.7040 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.1800 0.7400 4.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0110 -0.0500 6.7670 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6450 -2.9600 2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 1.8890 4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 3.1460 4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 1.4580 4.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 2.0540 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 2.4840 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 0.7950 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -1.5610 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -3.2870 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 0.2320 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 0.8680 3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -0.7610 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6710 0.4470 3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0780 0.8110 3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7360 -0.7870 7.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 -0.5430 8.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7070 -2.0050 7.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -1.8970 6.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -3.4230 3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -2.5030 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -3.7200 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 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 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 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 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 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 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 39 1 0 0 0 0 20 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 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END