ENAMINE-ZINC00227890 MOE2007 3D Structure written by MMmdl. 55 56 0 0 1 0 0 0 0 0999 V2000 3.5670 0.2570 8.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 1.2120 8.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 2.0200 9.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 2.9260 9.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 3.0560 8.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 2.2540 7.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 1.3430 7.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 2.4270 5.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 1.6880 4.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 2.1140 3.5600 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0810 3.2040 3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 1.4240 2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 2.8310 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 2.8420 -0.4090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7480 2.7710 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 1.7360 -1.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 0.4770 -0.6330 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7150 0.4110 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 0.3480 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -0.6250 -1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 4.1210 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 1.7500 3.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 4.0590 7.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 3.7400 8.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 5.4960 8.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 0.7450 8.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -0.0830 9.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -0.6330 8.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 1.9500 10.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 3.5380 10.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 0.7140 6.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 0.6160 4.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 1.9240 4.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 0.3590 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 1.8720 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 2.9070 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 3.6330 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -0.5750 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 0.3950 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -0.5610 -2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -1.6160 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -0.5210 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 4.2040 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 4.1180 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 5.0060 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 2.0360 4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 4.0070 6.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 3.8480 9.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 4.4150 8.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 2.7130 8.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 5.7300 7.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 6.2080 7.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 5.6710 9.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 1.5090 1.2650 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4030 1.4510 1.8700 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 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 54 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END