PUBCHEM-ZINC00076107 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.1590 1.5880 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 0.1090 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.5880 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -1.9320 0.7930 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -2.1220 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.8560 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.7640 -2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -1.9270 -3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -3.1770 -2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -3.2970 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -3.0270 1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -3.5340 2.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0140 -3.4050 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -5.0130 2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -6.7340 3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -7.2660 4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 -6.1390 2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -5.6330 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2440 -8.0000 3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -2.7700 3.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -3.3350 3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -0.0660 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 1.9890 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 1.8880 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 2.0520 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 0.2060 -3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -1.8500 -4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -4.0720 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -4.2800 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -3.8140 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -2.6790 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -5.6510 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -5.0940 3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -6.5810 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 -7.4970 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -8.2470 4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -6.5730 4.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5480 -5.4200 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6470 -6.3410 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 -6.3310 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -4.6760 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7390 -7.2930 3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0770 -8.9590 3.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8280 -8.1490 2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -0.4030 3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -0.4010 2.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 1.0280 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -5.4620 2.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 -7.4400 2.8920 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4660 -8.1230 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 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 32 1 0 0 0 0 14 33 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 48 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 49 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 48 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END