COMGENEX-ZINC06690250 MOE2007 3D Structure written by MMmdl. 46 47 0 0 0 0 0 0 0 0999 V2000 1.6470 7.7800 3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 8.1110 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 7.1390 0.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 5.8800 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 5.2300 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 3.9350 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 3.3200 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 4.0100 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 5.2830 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 7.2910 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 8.4170 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 8.1910 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8160 9.4160 1.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 10.3370 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 10.2330 2.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0310 11.5260 3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8090 13.1700 4.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 13.6080 2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 1.9140 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 1.4450 -1.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 6.8030 3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 7.7490 3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 8.5320 3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 9.1150 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 8.1180 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 5.6880 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 3.3760 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 3.5690 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 8.4950 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 9.3270 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 7.7390 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 7.5010 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 9.5690 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 11.1710 3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5290 11.9980 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7080 13.7010 4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 13.8530 5.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0560 12.3620 5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 13.0970 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 14.2320 3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 14.2020 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 6.1950 -0.4870 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0630 6.0340 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 12.5660 3.6980 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3310 12.0310 4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 1.3180 -0.3140 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 10 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 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 42 2 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 44 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 44 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 42 1 M CHG 1 44 1 M CHG 1 46 -1 M END