PUBCHEM-ZINC07000124 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 0 0 0 0 0 0999 V2000 -0.0900 1.2490 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -0.1010 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -0.4550 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 0.5620 0.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 1.6420 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 2.9170 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 3.2040 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 2.2510 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4600 2.4970 -0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8280 3.7780 0.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4380 4.3170 1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 4.4040 2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6780 3.9290 2.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6190 4.5340 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 5.7150 -0.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0200 3.8360 -1.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -1.6680 1.4220 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9840 -2.5850 1.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 -1.7220 1.4630 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9290 1.8850 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -0.7180 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 3.7350 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 4.2350 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 1.2030 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0530 5.3300 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 3.7080 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7330 2.8660 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 4.2730 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1670 4.9510 3.7020 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 29 -1 M END