5JK - Ideal conformer Mrv1927 01202215153D 75 78 0 0 0 0 999 V2000 0.7170 0.6760 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 0.0440 -0.5170 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0110 1.0090 -1.4930 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3480 1.4110 -0.8990 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2340 0.1950 -0.6410 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5310 0.6350 0.0180 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1960 1.6950 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4570 1.2720 -1.0220 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7640 1.6940 -0.3460 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.4830 0.4600 0.2010 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.7420 0.8480 0.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6250 -0.1880 1.2920 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2520 -0.4820 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 -1.6820 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -2.0910 0.3130 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5890 -2.6630 -0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -0.8570 0.2220 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2300 -1.2290 -0.4810 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6740 -2.2160 0.2660 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0730 -1.9420 -0.3520 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0330 -0.4910 -0.9020 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1380 0.3500 -0.2600 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0600 1.7840 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -0.2480 -0.6090 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6000 0.5170 0.1330 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9640 -0.0810 -0.2160 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0620 0.6830 0.5270 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9010 0.4720 2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4320 0.1680 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 0.8950 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -0.0180 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 1.5990 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 1.8920 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 0.5220 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 1.9360 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 2.0790 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -0.2640 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 2.5450 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 2.0260 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 1.2680 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 2.1470 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6710 0.5490 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 2.3780 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4030 2.1930 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6450 -0.2550 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3380 1.2670 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5290 0.4940 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0910 -1.1170 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -2.4180 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -2.8250 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -3.4470 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -0.4690 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -1.5780 -1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0040 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -3.2430 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -2.0270 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -2.6470 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -0.4950 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 0.3530 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 2.2100 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 2.3830 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 1.7810 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 -1.2970 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 -0.1700 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 1.5650 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4340 0.4390 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9880 -1.1300 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1310 -0.0040 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9820 1.7460 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 0.8390 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9810 -0.5910 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6830 1.0160 2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5470 0.3190 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2140 0.7130 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5120 -0.8950 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 16 15 1 0 0 0 0 11 10 1 0 0 0 0 12 10 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 13 2 0 0 0 0 15 17 1 0 0 0 0 10 9 1 0 0 0 0 13 6 1 0 0 0 0 19 18 1 0 0 0 0 19 20 1 0 0 0 0 17 18 1 0 0 0 0 17 5 1 0 0 0 0 18 2 1 0 0 0 0 9 8 1 0 0 0 0 5 6 1 0 0 0 0 5 4 1 0 0 0 0 20 21 1 0 0 0 0 6 8 1 0 0 0 0 6 7 1 1 0 0 0 21 2 1 0 0 0 0 21 22 1 0 0 0 0 2 3 1 0 0 0 0 2 1 1 1 0 0 0 4 3 1 0 0 0 0 24 22 1 0 0 0 0 24 25 1 0 0 0 0 26 25 1 0 0 0 0 26 27 1 0 0 0 0 28 27 1 0 0 0 0 22 23 1 0 0 0 0 27 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 37 1 6 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 45 1 6 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 1 0 0 0 16 51 1 0 0 0 0 17 52 1 1 0 0 0 18 53 1 6 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 58 1 6 0 0 0 22 59 1 1 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 27 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 M END