PUBCHEM-ZINC05599625 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0050 1.0030 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -0.3730 -0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -1.2890 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -0.7680 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.0110 -2.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.5560 -3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 0.2210 -4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 1.5440 -4.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 1.7070 -6.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 0.5200 -6.9190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -0.3870 -5.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -1.6420 -6.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -2.2870 -5.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -1.8290 -3.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 0.2670 -8.3550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3540 -0.6550 -8.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 0.2430 -8.8860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9400 1.0080 -8.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 0.7900 -10.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0710 1.2380 -10.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 1.8040 -10.1270 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4580 2.7590 -9.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 1.3300 -9.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 2.0230 -11.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 3.0480 -11.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.8070 -10.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -0.2920 -11.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -1.0440 -10.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8240 -1.0040 -8.9850 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1050 2.5500 -3.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 3.3780 -3.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 1.6850 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 1.2790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 1.1510 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -1.4160 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -2.2780 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -0.9020 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -1.8400 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 2.5540 -6.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -3.3100 -5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 1.1220 -11.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 2.3390 -12.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 30 31 3 0 0 0 0 M CHG 1 29 -1 M END