PEAKDALE-ZINC01739195 MOE2007 3D Structure written by MMmdl. 45 47 0 0 0 0 0 0 0 0999 V2000 2.0870 8.0910 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 7.2640 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 5.9290 0.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 5.1980 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 5.7970 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 7.1770 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 7.9150 0.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 7.8990 0.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 7.3770 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9790 8.5260 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 8.0050 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4060 9.0910 0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7760 9.8710 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7590 10.7190 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1520 9.4520 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 3.7330 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 2.8910 1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 1.5090 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 0.9360 0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 1.7390 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 3.1290 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 1.1250 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -0.1180 -1.1000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 1.8600 -1.6200 F 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 0.9770 0.2990 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 8.3240 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 7.5520 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 9.0280 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 5.2020 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 8.9010 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 6.7420 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 6.7630 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 9.1810 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 9.1490 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5670 7.3940 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6280 7.3720 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2850 9.7120 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3480 11.4900 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1060 9.0240 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 3.3010 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 0.8780 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -0.1420 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 3.7570 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9730 10.4300 -0.6050 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.6550 10.8880 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 44 1 0 0 0 0 15 39 1 0 0 0 0 15 44 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END