PUBCHEM-ZINC05159561 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 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 -1.7040 3.1480 -5.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 3.5910 -6.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 3.8370 -7.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 3.7780 -8.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 3.4960 -7.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 3.6720 -8.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 4.1280 -10.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 4.4100 -10.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 4.2330 -9.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 4.5030 -9.4820 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 0.5220 3.1410 -6.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 3.4550 -8.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 4.2630 -10.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 4.7650 -11.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 5.4170 -9.2810 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 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 21 1 0 0 0 0 4 5 1 0 0 0 0 4 19 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 25 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 M CHG 1 7 1 M CHG 1 21 -1 M END