KEYORGANICS-ZINC01389979 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 2.1920 3.7340 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 3.1540 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 1.6500 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 1.0010 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.3940 0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -1.1650 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -0.5140 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 0.8810 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -2.6670 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -3.3340 -0.8110 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -4.9210 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -7.0560 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -6.6170 -2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -5.2710 -2.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -4.4260 -3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -3.4740 -3.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -2.6800 -5.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -2.8490 -5.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -3.8190 -5.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -4.6180 -3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 3.4610 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 3.3720 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 4.8260 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 3.4740 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 3.5620 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 1.5810 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.8710 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -1.0850 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 1.3650 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -3.0690 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -3.0050 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -7.9950 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -7.1090 -2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -3.3560 -3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -1.9360 -5.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -2.2300 -6.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 -3.9470 -5.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -5.3500 -3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -5.9820 -0.5230 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8870 -5.9610 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 14 1 0 0 0 0 11 39 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END