PUBCHEM-ZINC05591580 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -1.1020 1.6690 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 0.2800 1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -0.2640 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -0.9520 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -2.0310 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -2.5550 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -3.9880 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -4.4900 1.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -5.7390 1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -6.4470 2.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -6.2560 1.6310 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4180 -5.9250 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 -5.7240 2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0480 -4.9260 2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8840 -4.4380 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 -4.7480 4.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5670 -5.5460 5.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 -6.0380 4.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -8.0690 1.6890 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -8.5080 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9130 -9.8420 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -10.1820 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -9.1970 -2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -7.8680 -1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -7.5210 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 2.3550 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 2.0330 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 1.6100 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 0.3400 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -0.0830 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.5740 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 0.8170 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -0.7310 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -0.5860 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -2.0300 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -2.0680 2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -2.6500 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 -1.9210 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -2.5430 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -4.6220 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -4.0000 2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -3.9240 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2370 -4.6840 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7250 -3.8140 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2960 -4.3660 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3790 -5.7880 6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 -6.6650 4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -10.6120 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 -11.2190 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -9.4660 -2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -7.1010 -2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -6.4830 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -0.6430 0.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 53 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 53 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 M END