IBS-ZINC04026242 MOE2007 3D Structure written by MMmdl. 41 45 0 0 1 0 0 0 0 0999 V2000 1.8420 5.0280 -6.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 4.9650 -7.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 4.2580 -6.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 3.6170 -5.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 3.6620 -5.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 4.3820 -5.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 2.9080 -3.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 2.4410 -3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 2.8600 -4.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 2.6600 -4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 1.5700 -2.1760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6110 0.5160 -2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 1.7740 -1.1930 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6900 2.8380 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 1.2800 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 1.1490 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 1.1510 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 1.2300 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 0.9530 0.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1880 -0.1200 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 1.2630 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 1.6420 -1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 2.6370 -3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 5.5840 -7.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 5.4730 -8.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 4.2120 -6.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 4.4380 -5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 1.9880 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 0.3090 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 1.0600 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 1.0790 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 0.4950 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 2.2230 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 1.9950 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 0.3570 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 1.7840 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 0.6010 -2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 3.5890 -2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 2.2520 -3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 1.8900 -1.2530 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6520 2.9080 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 40 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END