PUBCHEM-ZINC05631629 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 35 0 0 1 0 0 0 0 0999 V2000 -0.5960 1.4180 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 2.0660 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 2.6630 -1.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 2.0010 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 1.7230 -2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 1.4650 -3.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1240 1.6600 -2.9850 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 1.2420 -4.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2690 1.2640 -4.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8190 1.7010 -3.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9310 0.7560 -5.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3900 0.6530 -5.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.8270 0.4060 -4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0030 1.9410 -5.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9850 3.1070 -4.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7580 4.3030 -5.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0790 4.4770 -6.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0570 5.2250 -4.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5740 6.0530 -4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7820 5.1110 -3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7340 -0.4720 -6.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7390 -0.8370 -7.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 0.7350 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 0.8380 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 2.1910 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 2.1500 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 1.5950 -4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 1.9280 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 1.9260 -5.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 0.2260 -4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4370 0.3580 -5.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4740 2.2340 -6.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0440 1.7560 -6.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4210 2.7940 -3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9600 3.4440 -4.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9270 -0.8820 -6.3470 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 M CHG 1 36 -1 M END