COMGENEX-ZINC06836016 MOE2007 3D Structure written by MMmdl. 57 59 0 0 1 0 0 0 0 0999 V2000 -1.6650 0.8980 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 0.8650 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 2.2880 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 0.2010 -1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 0.8930 -2.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -1.1930 -1.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -2.1210 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -3.1800 -1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -2.8810 -3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -1.8430 -3.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -4.9870 -3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -6.1840 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -7.3440 -3.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -7.6130 -3.4100 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5200 -6.7170 -3.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 -8.9450 -4.6310 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -9.3230 -4.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -8.2040 -3.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -8.0720 -3.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -7.9620 -2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 -9.0010 -1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -9.3400 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -8.6410 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -7.6030 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 -7.2600 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3190 -6.2370 -2.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6250 -5.7260 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 1.4900 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -0.1030 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 1.3420 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 0.3080 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 2.7410 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 2.2850 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 2.9330 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -2.6100 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -1.6040 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -2.7260 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -3.9310 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -2.4150 -4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -3.4350 -4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -1.1120 -3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -2.3290 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -4.5390 -3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -5.3060 -4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -6.4780 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -5.9230 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -9.3800 -5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -10.2670 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -9.5620 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -10.1500 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 -8.9020 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3570 -7.0750 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8730 -5.0400 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3740 -6.5250 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6510 -5.1550 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -3.8950 -2.7410 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7180 -4.3460 -2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 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 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 56 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 56 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 11 56 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 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 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END