PUBCHEM-ZINC05637026 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.3270 1.1080 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 0.1430 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -0.4720 0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -0.1120 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 0.8560 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 1.4580 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 1.2260 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 2.1560 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 2.5530 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7340 2.0380 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2040 1.1200 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 0.7010 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -0.3110 -2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -1.4650 -1.6220 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0720 -0.7900 1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -0.1330 2.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 -2.1500 1.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -2.4970 1.6100 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 -3.8470 1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 -4.7240 1.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 -4.2460 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4770 -3.3010 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 -3.7050 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9770 -5.0530 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2140 -6.0200 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0710 -5.6000 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5840 -7.3760 -0.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7140 -7.8720 -0.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 -8.3930 0.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 1.5800 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -0.1350 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -1.2290 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 2.1950 -1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 2.5720 1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3400 3.2650 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7710 2.3490 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8310 0.7180 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1970 -2.2490 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2020 -2.9700 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8610 -5.3480 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 -6.3380 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3370 -7.9040 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9290 -9.0840 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 0.0760 -3.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 44 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 42 1 0 0 0 0 29 43 1 0 0 0 0 M CHG 1 14 -1 M END