IBS-ZINC04746342 MOE2007 3D Structure written by MMmdl. 53 55 0 0 0 0 0 0 0 0999 V2000 0.5950 5.2700 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 3.8230 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 2.9740 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 1.6210 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 1.1010 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 1.9340 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 3.2930 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 1.3830 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1410 2.3130 2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 1.9320 3.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 1.0370 3.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5580 -0.1810 2.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 0.2190 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1910 -0.3060 5.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 -0.7830 6.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 1.2380 7.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 1.7260 6.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -0.0760 9.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 5.3960 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 5.8850 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 5.6450 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 3.3610 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 0.9690 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 0.0380 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 3.9540 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 2.0700 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 0.4450 -0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 2.8700 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 2.9160 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 2.8660 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 1.4260 4.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6160 1.6070 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4850 -0.7610 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -0.8480 3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 0.7980 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -0.6720 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0380 0.3000 5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 -1.1830 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 -1.4410 7.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3410 -1.3120 7.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 0.6270 8.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 2.0900 8.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 2.2410 6.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7730 2.3960 6.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7070 0.8110 9.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5760 -0.6340 9.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -0.7070 9.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 1.0680 1.5430 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1980 0.5190 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9280 0.5610 5.3700 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.1140 -0.0270 5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4180 0.3870 7.9340 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.2410 0.9710 7.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 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 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 50 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 52 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 50 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 52 1 0 0 0 0 48 49 1 0 0 0 0 50 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 48 1 M CHG 1 50 1 M CHG 1 52 1 M END