PUBCHEM-ZINC05846037 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.5100 0.7740 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -0.5780 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -0.5340 -0.0540 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9840 0.2710 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -1.8730 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 0.2480 1.3650 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1910 -0.1780 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 1.7800 1.4130 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0120 2.0880 2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1120 2.0160 1.9450 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1300 2.8800 2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 0.8480 2.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 -0.0700 2.6880 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6960 0.1310 3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 -1.4410 2.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0660 -1.9210 2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 -3.2290 3.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -3.6140 3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -2.5140 2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -2.4920 2.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -3.7430 3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -4.8990 3.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 -4.8610 3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -6.0350 3.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 2.1690 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4850 2.3670 1.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 1.7450 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 2.2950 0.2180 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5990 0.6950 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 1.5280 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 1.1310 1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -0.9350 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -1.3000 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -2.0790 -1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -2.7010 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 -1.8820 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9370 -1.2820 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -3.8330 3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8570 -6.0040 3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 -6.8940 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1010 3.0330 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3630 1.2670 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -0.2560 1.3200 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1170 -1.1060 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 0.4790 1.7540 H 0 0 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 43 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 6 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 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 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 43 1 M END