CHEMDIV-ZINC00427498 MOE2007 3D Structure written by MMmdl. 41 44 0 0 0 0 0 0 0 0999 V2000 -1.3730 3.3430 3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 2.5840 2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 2.8700 2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 2.2620 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 1.3430 0.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 0.9990 0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 1.6490 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -0.3390 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 0.5670 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 0.7100 -0.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 1.8850 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 3.1020 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 4.2690 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 4.2400 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3720 3.0450 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 1.8630 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3060 0.6040 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -1.4090 -1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -2.4910 -1.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -3.3930 -2.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -2.9570 -3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -1.4690 -2.9770 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 4.4190 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 3.0500 2.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 3.1600 4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 3.5920 2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 2.4510 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 1.3770 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 -0.1170 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 3.1510 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 5.1980 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 5.1460 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4330 3.0440 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3570 -0.1160 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 0.8010 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 0.1570 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -2.6610 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -4.3170 -3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -3.4400 -4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.0070 -0.3800 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9700 -0.4500 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 40 2 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 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 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END