PUBCHEM-ZINC05555644 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.1180 1.4020 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 0.0160 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -0.6480 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 0.0890 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 1.4070 -0.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 2.0710 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -2.1540 -0.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3910 -2.5500 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.6750 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -4.1920 -1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -4.5260 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -4.0260 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -2.5950 0.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -1.7050 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -0.5390 1.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 -2.1400 2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 -1.2750 2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 -1.7120 3.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8050 -3.0230 3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 -3.4250 4.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6590 -2.5370 4.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2130 -1.2400 5.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 -0.8150 4.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4450 -4.8120 3.9020 N 0 3 0 0 0 0 0 0 0 0 0 0 7.8300 -5.5950 3.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4630 -5.1710 4.4670 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7410 1.9520 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -0.5340 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -0.4210 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 3.1510 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -2.4370 -2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -2.2050 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -4.6590 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -4.5690 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -5.6050 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 -4.0390 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -4.5770 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -4.1720 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 -3.1520 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 -0.2620 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2600 -3.7180 2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5600 -2.8620 5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7670 -0.5550 5.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6240 0.4600 4.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 0.5820 5.2930 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END