IFLAB-ZINC04071045 MOE2007 3D Structure written by MMmdl. 44 47 0 0 0 0 0 0 0 0999 V2000 -0.9750 11.3150 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 9.1300 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 7.8230 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 7.1370 -0.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 7.9040 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 9.2140 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 5.7630 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 5.0800 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 3.7450 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 3.0510 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 1.6580 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 0.9300 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 1.6020 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 3.0200 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 3.8060 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 5.1530 -0.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 3.2570 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 3.4100 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8180 2.8870 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3130 2.2080 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5200 2.0580 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 2.5840 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 11.8270 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 11.8860 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 11.1580 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 8.9360 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 9.7190 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 7.2180 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 8.0420 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 8.1300 -1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 7.3550 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 9.0220 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 9.8600 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 3.6090 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 1.1480 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -0.1550 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 1.0140 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 3.9380 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4400 3.0110 -2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3200 1.7980 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9090 1.5330 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 2.4630 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 9.9800 0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9020 10.1520 -0.9910 H 0 0 0 0 0 0 0 0 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 1 43 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 2 43 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 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 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 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 43 1 M END