PUBCHEM-ZINC04123427 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5120 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -1.9790 1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -2.4180 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -1.8900 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2260 -2.3240 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.4660 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -2.2760 -2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -2.4810 2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -1.6400 3.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -2.0880 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -3.4590 4.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 -4.3090 3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -3.7910 2.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -5.6500 3.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -6.4560 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -3.9980 5.7240 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6460 -4.2910 6.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 -4.1490 5.7410 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8950 -1.2020 5.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -0.0900 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.2100 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -2.0260 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -3.5070 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -3.3620 -2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -1.9010 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -1.8410 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -7.5060 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -6.2980 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -6.1770 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -0.2490 5.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 -1.5360 6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END