PUBCHEM-ZINC03874454 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.0660 0.8850 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.5390 1.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -1.1560 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -2.5520 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -3.0910 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.4290 -0.8790 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 -1.1080 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -0.4420 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -4.4370 -0.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -4.6600 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -3.5410 0.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -5.4110 -1.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5540 -4.8760 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -6.2040 -0.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8080 -6.3440 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -7.5370 0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8480 -8.3190 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -7.6950 -1.3410 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1170 -8.1330 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -6.3470 -1.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -8.4560 -1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -9.8650 -1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 -10.5710 -0.0410 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -10.5460 -0.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -7.4440 1.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -8.4330 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -5.6160 1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 -6.0720 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 1.1670 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 1.4100 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 1.2270 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -1.1400 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 -0.4920 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -5.6510 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -8.2250 -2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -8.1060 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -11.9530 0.0500 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6470 -9.6360 1.1330 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 37 -1 M CHG 1 38 -1 M END