IBS-ZINC06759399 MOE2007 3D Structure written by MMmdl. 44 46 0 0 0 0 0 0 0 0999 V2000 3.0480 -2.4450 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -1.7760 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -2.5570 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -1.9450 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -0.6100 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 0.1080 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -0.3670 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 0.7370 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 1.9780 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 1.7950 -0.0400 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 3.1570 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 3.0240 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 1.7880 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 0.6210 -0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 4.4040 -0.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 5.6120 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 6.8340 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 8.1290 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 10.5680 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 9.6230 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -2.7980 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 -2.1670 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 -2.1440 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -3.5360 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -3.6420 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 1.7340 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 4.4430 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 5.6410 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 5.6370 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 6.7870 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 6.8010 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 8.1460 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 8.2530 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 10.8010 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 11.3880 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 10.3490 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 8.7710 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 10.5130 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 9.7860 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 -3.4420 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -3.4200 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -2.1780 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 9.3400 0.0540 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1140 9.1510 0.8310 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 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 43 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 43 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 43 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 43 1 M END