PUBCHEM-ZINC00905803 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 77 0 0 1 0 0 0 0 0999 V2000 1.3320 1.8090 1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 0.3320 1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -0.4780 1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -1.8250 1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -2.6710 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -4.0390 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -4.5690 1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -3.7220 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -2.3540 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -5.9570 1.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -6.8530 0.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6310 -7.8880 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -6.6170 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -7.6280 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -7.4000 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -6.1580 -3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -5.1960 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -5.4460 -0.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -6.5790 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -5.5220 1.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -7.5090 0.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 -7.2420 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 -8.5680 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 -8.2900 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0310 -7.5190 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -6.1940 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 -6.4720 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -6.4690 2.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -5.7310 3.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -7.9570 2.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -8.2570 4.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -8.4980 5.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -8.7220 6.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 -8.6050 5.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 -8.3270 4.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 -9.0410 7.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 -9.2530 8.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 -9.5500 9.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 -9.6360 10.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -9.4250 9.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 -9.1220 8.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 2.0510 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 2.4270 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 2.0010 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 0.0910 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 0.1410 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -2.2580 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -4.6970 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -4.1340 3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -1.6960 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -8.5840 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -8.1720 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -5.9460 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -4.2260 -2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -8.3540 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -6.6490 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -9.1610 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -9.1170 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 -9.2340 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8460 -7.6970 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7990 -8.1130 -1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1020 -7.3210 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5650 -5.6450 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5010 -5.6010 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -5.5280 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 -7.0650 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -8.4580 2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -8.3090 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5450 -9.1870 7.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 -9.7150 10.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -9.8680 11.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -9.4940 9.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -8.9530 7.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 45 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 47 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 28 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 51 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 16 17 2 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 31 32 1 0 0 0 0 31 35 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 33 36 1 0 0 0 0 34 35 2 0 0 0 0 36 37 1 0 0 0 0 36 41 2 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 40 2 0 0 0 0 39 71 1 0 0 0 0 40 41 1 0 0 0 0 40 72 1 0 0 0 0 41 73 1 0 0 0 0 M END