IFLAB-ZINC04340615 MOE2007 3D Structure written by MMmdl. 45 47 0 0 0 0 0 0 0 0999 V2000 -3.7070 -0.8110 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -0.0270 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 1.3670 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 2.1050 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 1.4230 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 0.0020 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -0.6920 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -0.6340 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 0.1810 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 1.5660 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 2.4530 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -2.0190 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -2.7350 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 -4.2480 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -5.0120 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 -5.3570 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6030 -6.0410 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2210 -6.3830 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 -6.0430 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -5.3590 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 3.6080 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -1.0340 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 -0.2490 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -1.7510 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 1.8800 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -1.7780 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 -0.2520 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 2.2730 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 3.5090 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 2.2600 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.5880 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -2.4540 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -2.4610 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -4.5420 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -4.5350 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 -5.0970 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 -6.3080 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 -6.9160 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 -6.3110 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -5.1000 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 4.0280 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 3.9550 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 4.0020 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 2.1240 0.0010 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0770 3.1410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 44 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END