PUBCHEM-ZINC01529258 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 49 0 0 1 0 0 0 0 0999 V2000 0.6460 1.7040 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 0.2200 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -0.4400 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.2430 -1.8560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4640 0.5380 -2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -1.3910 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -1.3060 -2.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -2.4250 -2.8270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -3.6320 -3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -4.5190 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -5.8710 -4.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -5.8240 -5.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -7.1690 -6.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -7.0680 -7.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -8.6690 -8.4920 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -8.1630 -10.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -9.3040 -10.9650 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7520 -9.5310 -10.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 -8.9130 -12.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -9.7400 -13.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 -4.0150 -3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 -4.4870 -1.8780 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1210 -0.5520 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.2330 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 2.1220 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.9110 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 0.1740 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -1.4380 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -2.2930 -2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -4.2680 -4.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -6.5850 -4.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -6.2500 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -5.0460 -6.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -5.5480 -6.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -7.9340 -6.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -7.4690 -5.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -6.3090 -8.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -6.7870 -8.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -7.3030 -10.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -7.8380 -10.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -0.2560 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -1.6350 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -0.3490 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -7.9180 -12.8240 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.9290 -10.5810 -10.8410 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5360 -10.6420 -11.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -11.4130 -10.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -10.5090 -10.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 -3.8930 -4.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 45 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 21 22 1 0 0 0 0 21 49 2 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 M CHG 1 22 -1 M CHG 1 44 -1 M CHG 1 45 1 M END