CHEMDIV-ZINC04741780 MOE2007 3D Structure written by MMmdl. 54 57 0 0 1 0 0 0 0 0999 V2000 1.6210 1.4810 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 1.1160 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -0.3370 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -0.6820 0.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -0.8990 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 0.4230 1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 0.1940 3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -0.8040 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -0.9930 -2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -1.1530 -3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 -1.1330 -3.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 -0.9140 -2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -0.7580 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -1.3680 -5.0460 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1540 -1.3960 -4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -0.3220 -5.9550 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -0.5530 -7.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -1.7040 -7.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -2.7240 -6.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -2.6380 -5.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 -3.9260 -5.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 -4.4070 -4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -5.7950 -3.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -6.6480 -4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -6.1570 -5.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 -4.7820 -5.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 0.5740 -7.7070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 1.3700 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 0.8450 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 2.5220 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 1.2870 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 1.7930 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -1.0320 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.4670 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -1.6010 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 -1.3960 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 1.0500 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 0.9880 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 -0.3960 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -0.3350 3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 1.1510 3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -1.0440 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -1.3070 -4.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2490 -0.8720 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 -0.5840 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 0.6080 -5.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1430 -3.7530 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0950 -6.2290 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -7.7190 -4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -6.8020 -6.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 0.5060 -8.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 1.4930 -7.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -3.9790 -6.8760 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9430 -4.2600 -7.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 53 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 53 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END