PUBCHEM-ZINC06042508 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -0.8170 1.0410 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -0.4570 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -0.7770 0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -2.2860 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -2.6060 2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -4.1130 2.4240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2000 -4.5120 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -4.3720 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -4.8170 1.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -6.1140 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -6.7970 1.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -6.6050 -0.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0650 -5.9270 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -8.0270 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -9.1070 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -8.8880 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 -7.5620 0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 -6.5920 -0.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2990 -6.9590 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -5.2380 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8230 -4.2310 0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 1.4760 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 1.2470 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 1.5460 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -0.8660 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -0.9350 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -0.3640 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -0.2930 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -2.6990 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -2.7650 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -2.2030 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -2.0920 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -4.0110 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -3.8710 4.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -5.4440 3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -4.3360 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -8.1240 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -8.2090 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -10.0960 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -9.6990 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -7.1250 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 -7.7470 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8500 -5.2790 0.1900 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 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 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 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 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 M CHG 1 43 -1 M END