COMGENEX-ZINC06776502 MOE2007 3D Structure written by MMmdl. 60 63 0 0 1 0 0 0 0 0999 V2000 6.9770 5.9950 5.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 6.9980 3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 6.6510 2.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 5.7530 1.8790 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3130 4.5560 2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4460 4.8810 3.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 6.0700 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 7.1360 0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 5.0540 -0.5440 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4390 4.0220 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 5.3730 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8250 5.1950 -2.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 5.4890 -2.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 5.1770 -1.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 4.9970 -1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 5.1890 -2.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 4.5660 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 3.8800 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 2.5140 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 1.8790 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 2.6040 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 3.9650 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 4.6020 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 6.9840 -3.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 7.3700 -4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 6.5050 -5.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 5.0240 -5.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 4.5580 -4.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5110 6.5500 6.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3500 5.0340 5.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7780 6.5760 5.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 7.5770 3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 7.5500 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 7.5770 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 6.1300 3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 3.8900 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7370 4.0230 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 5.4610 2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8650 3.9640 3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 4.7060 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2170 6.4040 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 5.4590 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 3.8820 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 1.9350 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 0.8200 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 2.1090 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 4.5320 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 5.6670 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 7.6050 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 7.2570 -3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 8.4220 -4.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 7.2940 -3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 6.6800 -6.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 6.8010 -6.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 4.4410 -6.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 4.8030 -4.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 4.4350 -4.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 3.5490 -3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 5.7190 4.4480 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1810 5.1750 4.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 59 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 7 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 6 38 1 0 0 0 0 6 39 1 0 0 0 0 6 59 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END