IFLAB-ZINC02576212 MOE2007 3D Structure written by MMmdl. 43 46 0 0 0 0 0 0 0 0999 V2000 0.0380 0.8380 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.4100 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 1.6180 2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 2.1440 3.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 2.4650 3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 2.2620 2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 1.7360 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 1.5220 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 2.6200 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 3.7340 -0.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 2.3120 -2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 3.2920 -3.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0990 2.9800 -4.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6070 1.6900 -4.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 0.7080 -3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 1.0080 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 0.0580 -1.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 0.2810 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -0.8290 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -2.0250 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -3.0570 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -2.9150 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 -1.7360 2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -0.6930 1.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -4.0300 3.2740 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4400 -3.9090 4.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -5.0690 2.8500 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.4230 1.3930 -5.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.2490 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 1.1340 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.2160 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 1.3700 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 2.3050 4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 2.8750 4.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 2.5130 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 4.2930 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 3.7370 -4.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 -0.2900 -3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -2.1380 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -3.9800 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -1.6330 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 0.2260 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3620 1.5330 -5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 2 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 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 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 28 43 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END