PUBCHEM-ZINC06416248 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 43 0 0 1 0 0 0 0 0999 V2000 0.0230 2.1180 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 0.8740 -0.5700 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2660 -0.0210 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 0.8850 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 1.7290 1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -0.1700 1.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.8810 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -0.5030 2.8960 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9380 -0.3080 2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 0.2650 4.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 1.7170 4.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 2.2920 5.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 4.7980 5.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 4.7630 4.6830 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5210 5.6010 4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 3.8920 4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 5.9960 5.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 6.0700 6.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 6.8590 5.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -2.0280 3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -2.5870 2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 0.8340 -1.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 0.2900 -2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -0.1690 -3.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 0.2660 -3.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 3.0340 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 2.1270 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 2.1590 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 0.2560 3.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -0.2510 5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 1.7650 4.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 2.3310 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 2.2770 5.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 1.6850 6.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 1.2310 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 1.2780 -4.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -0.2080 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 3.6640 5.7650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 3.7680 6.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -2.5040 4.1620 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6480 -0.5330 -4.9780 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3710 -1.4890 -4.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 -0.5840 -5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -0.1380 -5.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 41 1 0 0 0 0 38 39 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 M CHG 1 14 1 M CHG 1 40 -1 M CHG 1 41 1 M END