IBS-ZINC06759161 MOE2007 3D Structure written by MMmdl. 54 57 0 0 0 0 0 0 0 0999 V2000 -1.1440 -1.3630 -5.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -1.2510 -4.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -2.0130 -3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -1.9270 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -1.0850 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -0.3360 -2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -0.4240 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -0.9370 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 0.0200 0.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 1.3810 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 1.8900 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 0.7300 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -0.4080 0.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 3.2930 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 4.0210 0.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 3.3970 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 2.0790 0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 3.9770 1.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 3.4620 2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 3.4600 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 5.3870 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 5.3340 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 4.9300 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2970 4.5880 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9980 3.4580 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7070 5.5880 2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -2.1600 -6.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -0.4230 -6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -1.5870 -6.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -2.6770 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -2.5100 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 0.3330 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 0.1610 -4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -1.8950 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -0.5900 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 0.6510 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 4.0410 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 4.1200 3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 2.4700 2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 2.7850 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 3.1770 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 4.7590 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 6.4170 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 5.6740 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 6.0360 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 4.2610 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1910 5.9540 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8710 3.2210 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7280 2.7350 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9240 5.6960 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6260 5.2910 2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8860 6.5650 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 4.8630 0.9390 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8760 5.4910 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 53 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END