PUBCHEM-ZINC06545596 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 1.7950 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 2.2560 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 2.4880 -3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 2.2560 -3.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 1.8230 -2.3220 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6970 2.9880 -4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 3.1460 -5.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 3.6180 -6.9610 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1150 3.0130 -7.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 3.5130 -8.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9060 2.4680 -8.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 4.0770 -9.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5890 3.4750 -9.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 5.5210 -9.1290 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6440 5.9120 -10.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 5.5480 -7.9980 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1020 4.9690 -8.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 4.9820 -6.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 6.9950 -7.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 7.0120 -6.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 6.3240 -8.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 4.0490 -10.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 4.2620 -7.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 2.4980 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 3.8450 -1.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 1.5530 -0.0090 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 2.4340 -4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 2.2690 -5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 3.9480 -4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 7.5520 -7.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 7.4540 -8.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 7.8990 -6.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 6.3490 -9.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 3.1630 -10.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 3.9610 -6.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 2.3300 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 1.8120 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 4.0710 -1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.6720 -2.3350 H 0 0 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 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 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 M CHG 1 7 1 M CHG 1 28 -1 M END