PUBCHEM-ZINC05512692 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 67 0 0 1 0 0 0 0 0999 V2000 2.7390 1.2410 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -0.1370 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -0.6910 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -2.0770 -0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -2.6310 -2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -3.9660 -2.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -4.0340 -2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -3.6690 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -3.9460 -4.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -3.6000 -6.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 -3.8840 -6.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -5.0650 -1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -4.9330 -1.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -6.4830 -1.9510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4930 -6.4700 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -6.9870 -3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -8.0670 -3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -8.2290 -5.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -7.3540 -5.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -7.3310 -1.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -8.3580 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -8.7030 -0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -9.0730 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -8.4280 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -9.1400 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -10.5000 2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 -11.1500 1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -10.4240 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 -12.6020 1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 -11.2300 3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 1.2050 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 1.9540 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 1.6180 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -0.8170 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -0.0720 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -0.0050 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -0.7490 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -2.7630 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -2.0210 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -1.9560 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -2.6860 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -5.0300 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -3.3480 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.6090 -4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -4.2340 -4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -5.0030 -4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -3.3590 -4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -2.5410 -6.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -4.1830 -6.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 -3.6290 -7.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -4.9430 -6.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -3.2930 -6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -6.1530 -4.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -7.3800 -3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -9.0160 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -7.7810 -3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -7.1050 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0860 -7.3690 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 -8.6210 2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -10.9170 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -12.7750 2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -12.9310 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -13.2240 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 -11.5660 3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 -12.0930 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 -10.5870 3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -9.2150 -5.6640 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 19 2 0 0 0 0 18 67 1 0 0 0 0 20 21 1 0 0 0 0 20 57 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 M CHG 1 67 -1 M END