IBS-ZINC06665625 MOE2007 3D Structure written by MMmdl. 52 54 0 0 0 0 0 0 0 0999 V2000 1.1130 -2.3280 11.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -3.5310 10.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -3.1220 9.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -4.3360 8.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -3.9730 7.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -3.9780 7.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -3.6130 5.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -3.3390 5.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -3.5740 5.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -3.4600 5.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -3.0840 4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -2.7800 3.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -2.8940 3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -2.3350 2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -0.8210 2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -0.3010 0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 1.1440 0.9760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 2.1300 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 3.3340 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 1.7330 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 -3.5430 5.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -4.3500 8.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -2.6440 12.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -1.6060 10.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -1.8220 11.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -4.2470 11.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -4.0330 10.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.3980 8.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -2.6100 9.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -5.0780 8.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -4.8400 7.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -2.9590 4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -2.6440 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -2.8380 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -0.5350 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -0.3340 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -0.5170 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -0.7770 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.8380 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 4.3630 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 1.2320 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -4.1520 4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1820 -3.9200 6.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 -2.5080 5.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -3.9160 9.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5420 -3.9870 8.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 -5.4390 8.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -2.7210 3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 3.0530 1.3870 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8440 3.7440 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -2.6220 2.9850 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3980 -2.3120 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 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 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 51 2 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 49 1 0 0 0 0 20 41 1 0 0 0 0 20 49 2 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 48 51 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 49 1 M CHG 1 51 1 M END