PUBCHEM-ZINC03872139 MOE2007 3D CORINA 3.40 0006 02.08.2006 74 76 0 0 1 0 0 0 0 0999 V2000 -0.3470 1.4780 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -0.1970 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 0.7180 1.9540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -1.4460 1.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 -1.5660 2.6500 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8170 -0.9120 3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -2.9820 3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -3.7010 2.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -3.5200 3.8110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -3.3780 5.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -4.5080 5.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -4.9830 4.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -4.3550 3.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6110 -5.1300 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -3.4840 2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -2.2760 2.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -4.0680 1.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -3.0770 0.4860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9810 -2.5270 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -2.1330 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -2.5720 -0.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -0.7900 0.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -3.7940 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -4.7030 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -5.4200 -1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6550 -6.3290 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2360 -7.0460 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3670 -7.9410 -1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -8.0000 -0.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0330 -8.6760 -2.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0960 -9.5180 -2.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -1.1700 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 0.2900 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 1.2460 2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 2.5850 2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 2.9680 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 2.0110 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 0.6720 0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.5070 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 2.0530 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 1.6100 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 1.8260 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -2.1800 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -3.4610 5.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -2.4120 5.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -5.3220 6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -4.1310 6.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -6.0700 4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -4.6470 4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 -5.0210 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -0.3800 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -3.0570 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -4.3940 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -5.4400 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 -4.1030 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -4.6830 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 -6.0200 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -7.0660 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 -5.7280 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6080 -6.3090 -3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -7.6460 -2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7840 -8.6290 -3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5130 -10.0050 -3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 -1.3430 3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0910 -1.7700 1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 0.9470 4.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 3.3320 3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 4.0130 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 2.3100 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -0.0760 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 0.2570 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -1.4160 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -0.7200 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 40 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 63 1 0 0 0 0 32 64 1 0 0 0 0 33 34 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 67 1 0 0 0 0 36 37 1 0 0 0 0 36 68 1 0 0 0 0 37 38 2 0 0 0 0 37 69 1 0 0 0 0 38 39 1 0 0 0 0 38 70 1 0 0 0 0 39 71 1 0 0 0 0 40 72 1 0 0 0 0 40 73 1 0 0 0 0 40 74 1 0 0 0 0 M END