COMGENEX-ZINC06775033 MOE2007 3D Structure written by MMmdl. 51 53 0 0 1 0 0 0 0 0999 V2000 4.4710 3.2370 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 4.1070 1.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 4.2590 2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 5.2110 2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 4.6570 1.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 3.8840 1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 3.6090 2.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 3.4100 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 3.0540 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1130 3.2380 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4440 4.6360 0.7320 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6960 5.1720 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5950 6.5220 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 6.8030 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 5.6120 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 5.3140 0.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5880 5.6230 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 6.0700 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 5.8840 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 6.5690 -3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 7.4510 -3.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 7.6580 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 6.9700 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 8.4870 -1.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 9.2550 -2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 3.6380 2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 2.2380 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 3.1600 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 4.6790 3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 3.2800 2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 6.1540 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 5.4230 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 4.8520 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 3.7940 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 2.3160 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 1.9960 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 3.4540 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 2.8570 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4080 2.7140 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5580 4.5630 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4160 7.2280 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 7.7750 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 5.2200 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 6.4220 -4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 7.9640 -3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 7.1520 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 8.6080 -3.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 9.9220 -2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 9.8780 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 3.8040 0.1590 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1800 3.5250 -0.7600 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 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 50 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 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END