PUBCHEM-ZINC06079498 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7710 -2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -2.0340 -3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -4.2350 -2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -4.7650 -2.4100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9360 -4.3410 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -6.2900 -2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 -6.7760 -2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -8.1200 -2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -8.6600 -1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 -10.0270 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -10.8570 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -10.3210 -1.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -8.9550 -2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -12.3210 -1.6750 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4940 -12.7940 -1.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -13.0530 -1.6820 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.0550 -4.3920 -3.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8530 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1420 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -1.8370 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -2.6270 -4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -1.0890 -3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -4.5890 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -4.5950 -1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -6.7190 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -6.5780 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -8.0120 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 -10.4470 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -10.9710 -1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -8.5380 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -4.7350 -4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 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 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 43 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END