PUBCHEM-ZINC06260171 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 36 0 0 1 0 0 0 0 0999 V2000 0.3730 -0.2990 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -1.6000 -0.9080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3490 -2.4600 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -1.5950 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -1.5990 1.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -1.7370 -0.9190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -1.9480 -2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -2.0870 -3.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -2.0870 -1.7560 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9930 -3.0090 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 -0.8730 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9550 -0.9970 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4830 0.2130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6340 -0.4560 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0010 -1.2530 2.0370 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.5140 -1.7350 2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9970 -1.3830 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9780 -0.2980 1.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5030 0.2930 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5090 -0.7490 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -0.2030 -1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -0.2430 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.5700 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -1.6780 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -0.7160 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2580 0.0320 -1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5060 -1.0810 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 -1.9130 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 0.3060 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2470 1.1350 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -1.6010 0.7560 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.9510 0.1890 0.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4960 0.8110 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -2.2910 -3.0900 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6390 -1.4020 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 -2.8110 -3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -2.8180 -3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 34 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 M CHG 1 15 1 M CHG 1 31 -1 M CHG 1 34 1 M END