PUBCHEM-ZINC06302270 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 2.6030 -0.4810 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -0.7830 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -1.2870 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -1.6130 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -1.4330 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -0.9350 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.6040 -0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -0.1350 -2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 1.1450 -2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 1.7150 -3.9590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1390 1.3830 -4.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 3.1550 -3.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 3.5360 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 4.6780 -2.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 2.2950 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 2.3160 -0.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 4.0560 -4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 5.2970 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 7.2270 -3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 8.1660 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 8.9230 -2.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 8.0660 -3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 7.1230 -4.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 1.3810 -4.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 2.0840 -4.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 1.7830 -4.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 0.7610 -5.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 0.0340 -5.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 0.3270 -5.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -0.3800 -5.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -1.3540 -6.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 0.3700 -6.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 1.0270 -5.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -1.1750 -3.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -2.1030 2.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -2.4190 3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -1.1380 -2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 0.5640 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -0.6350 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -1.4400 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -1.6780 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -0.8220 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 4.3440 -5.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 3.4820 -5.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 5.8170 -5.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 4.9960 -4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 6.6010 -3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 7.7820 -4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 8.8750 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 7.6120 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 8.7030 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 7.5100 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 7.6810 -5.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 6.4330 -4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 2.8770 -3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2880 2.3610 -4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -0.7750 -6.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -0.9020 -7.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -1.7570 -6.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -2.1850 -6.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1240 0.8740 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9490 2.0930 -5.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8250 0.5830 -6.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -0.8770 -4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -2.7750 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -1.5320 4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -3.2240 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 6.3060 -3.8590 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5290 5.7610 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 40 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 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 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 68 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 68 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 23 68 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 35 36 1 0 0 0 0 36 65 1 0 0 0 0 36 66 1 0 0 0 0 36 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END