OTAVA-ZINC00943966 MOE2007 3D Structure written by MMmdl. 53 58 0 0 0 0 0 0 0 0999 V2000 -0.0060 1.0360 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 1.5640 1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 3.0770 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 3.7100 1.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 5.0590 1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 5.8380 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 7.1800 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 7.2170 2.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 5.9150 2.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 5.5230 3.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 5.3350 2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 4.9640 2.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6810 5.9640 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8540 5.6240 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1890 4.2830 4.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3530 3.2820 3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1790 3.6190 2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 8.3410 2.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 9.4640 2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 9.4440 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 8.3020 1.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 10.6430 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 11.6160 0.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 10.6900 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 11.6950 2.7850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 5.1140 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 3.7790 0.7430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 3.3380 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 2.0850 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6480 2.0700 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3330 3.2500 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 4.5080 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 4.5170 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.0570 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 1.4150 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3430 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 1.1260 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 1.2750 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 6.2930 3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 4.5990 3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 4.5610 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 6.2510 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 7.0140 3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5080 6.4030 4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1040 4.0180 4.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 2.2370 3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 2.8250 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 1.1530 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0830 1.1110 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 3.1770 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3380 5.4260 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 5.5830 0.1660 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0880 6.5690 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 21 2 0 0 0 0 8 9 1 0 0 0 0 8 18 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 3 0 0 0 0 24 25 3 0 0 0 0 26 27 1 0 0 0 0 26 52 2 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 33 1 0 0 0 0 32 51 1 0 0 0 0 33 52 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END