ASINEX-ZINC01329603 MOE2007 3D Structure written by MMmdl. 45 48 0 0 0 0 0 0 0 0999 V2000 7.8020 6.4630 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0690 5.1540 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6880 5.1250 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 3.9000 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 2.7530 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0910 2.7480 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7620 3.9790 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2400 4.0280 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 1.7440 -0.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 2.2270 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 0.7890 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4660 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 0.1090 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -0.5940 0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 0.0770 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 1.3890 0.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 2.0470 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -0.8360 0.4970 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 0.4760 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -0.0700 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -0.6420 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9490 -1.1590 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7560 -1.1150 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -0.5550 1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9720 -0.0420 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5170 0.4910 2.3320 F 0 0 0 0 0 0 0 0 0 0 0 0 8.2270 6.7790 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1330 7.2600 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6010 6.3650 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 5.9980 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5880 1.8420 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4400 4.7400 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8020 4.3170 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6160 3.0510 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -0.4180 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -1.6490 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 3.0920 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 1.2690 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 0.9300 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -0.6910 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3300 -1.6000 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7650 -1.5190 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8820 -0.5170 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 3.5220 0.4890 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0090 4.1410 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 10 44 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END