atom 0.000000 0.000000 0.000000 1 fuf.o 0.000000 14.852336 450.281281 15.999790 ; mompar 1 8.741000 13.364000 ; atom 0.000000 0.000000 0.000000 2 fuf.c1 -0.459000 26.171597 1056.904663 12.000000 ; mompar 2 5.343000 10.126000 ; atom 0.000000 0.000000 0.000000 3 fuf.c2 -0.459000 26.171597 1056.904663 12.000000 ; mompar 3 5.343000 10.126000 ; atom 0.000000 0.000000 0.000000 4 fuf.c3 -0.459000 26.171597 1056.904663 12.000000 ; mompar 4 5.343000 10.126000 ; atom 0.000000 0.000000 0.000000 5 fuf.c4 -0.459000 26.171597 1056.904663 12.000000 ; mompar 5 5.343000 10.126000 ; atom 0.000000 0.000000 0.000000 6 fuf.c5 -0.459000 26.171597 1056.904663 12.000000 ; mompar 6 5.343000 10.126000 ; atom 0.000000 0.000000 0.000000 7 fuf.n6 0.000000 18.213057 631.409485 14.007000 ; mompar 7 7.649000 10.010000 ; atom 0.000000 0.000000 0.000000 8 fuf.1h1 0.153000 7.130669 121.200447 1.008000 ; mompar 8 4.528000 13.890400 ; atom 0.000000 0.000000 0.000000 9 fuf.1h2 0.153000 7.130669 121.200447 1.008000 ; mompar 9 4.528000 13.890400 ; atom 0.000000 0.000000 0.000000 10 fuf.2h2 0.153000 7.130669 121.200447 1.008000 ; mompar 10 4.528000 13.890400 ; atom 0.000000 0.000000 0.000000 11 fuf.1h3 0.153000 7.130669 121.200447 1.008000 ; mompar 11 4.528000 13.890400 ; atom 0.000000 0.000000 0.000000 12 fuf.2h3 0.153000 7.130669 121.200447 1.008000 ; mompar 12 4.528000 13.890400 ; atom 0.000000 0.000000 0.000000 13 fuf.1h4 0.153000 7.130669 121.200447 1.008000 ; mompar 13 4.528000 13.890400 ; atom 0.000000 0.000000 0.000000 14 fuf.2h4 0.153000 7.130669 121.200447 1.008000 ; mompar 14 4.528000 13.890400 ; atom 0.000000 0.000000 0.000000 15 fuf.1h5 0.153000 7.130669 121.200447 1.008000 ; mompar 15 4.528000 13.890400 ; atom 0.000000 0.000000 0.000000 16 fuf.2h5 0.153000 7.130669 121.200447 1.008000 ; mompar 16 4.528000 13.890400 ; atom 0.000000 0.000000 0.000000 17 fuf.1hn6 0.153000 2.373183 13.424753 1.008000 ; mompar 17 4.528000 13.890400 ; atom 0.000000 0.000000 0.000000 18 fuf.2hn6 0.153000 2.373183 13.424753 1.008000 ; mompar 18 4.528000 13.890400 ; bond 1 2 1.441237 433.253933 ; bond 1 5 1.441237 433.253933 ; bond 2 8 1.117602 347.682872 ; bond 2 6 1.524000 303.953122 ; bond 2 3 1.524000 303.953122 ; bond 3 9 1.117602 347.682872 ; bond 3 10 1.117602 347.682872 ; bond 3 4 1.524000 303.953122 ; bond 4 11 1.117602 347.682872 ; bond 4 12 1.117602 347.682872 ; bond 4 5 1.524000 303.953122 ; bond 5 13 1.117602 347.682872 ; bond 5 14 1.117602 347.682872 ; bond 6 15 1.117602 347.682872 ; bond 6 16 1.117602 347.682872 ; bond 6 7 1.473674 364.182832 ; bond 7 17 1.068488 431.021257 ; bond 7 18 1.068488 431.021257 ; angle 2 1 5 71.936722 104.510002 ; angle 1 2 8 59.553268 109.470001 ; abc 1 2 8 109.470001 -59.470001 0.594059 -435.632422 -426.793268; angle 1 2 6 71.983284 109.470001 ; abc 1 2 6 109.470001 -59.470001 0.594059 -435.632422 -292.078532; angle 1 2 3 71.983284 109.470001 ; abc 1 2 3 109.470001 -59.470001 0.594059 -435.632422 -292.078532; angle 8 2 6 42.765697 109.470001 ; abc 8 2 6 109.470001 -59.470001 0.594059 -426.793260 -292.078532; angle 8 2 3 42.765697 109.470001 ; abc 8 2 3 109.470001 -59.470001 0.594059 -426.793260 -292.078532; angle 6 2 3 53.319973 109.470001 ; abc 6 2 3 109.470001 -59.470001 0.594059 -292.078532 -292.078532; angle 2 3 9 42.765697 109.470001 ; abc 2 3 9 109.470001 -59.470001 0.594059 -292.078532 -426.793268; angle 2 3 10 42.765697 109.470001 ; abc 2 3 10 109.470001 -59.470001 0.594059 -292.078532 -426.793268; angle 2 3 4 53.319973 109.470001 ; abc 2 3 4 109.470001 -59.470001 0.594059 -292.078532 -292.078532; angle 9 3 10 40.843185 109.470001 ; abc 9 3 10 109.470001 -59.470001 0.594059 -426.793260 -426.793268; angle 9 3 4 42.765697 109.470001 ; abc 9 3 4 109.470001 -59.470001 0.594059 -426.793260 -292.078532; angle 10 3 4 42.765697 109.470001 ; abc 10 3 4 109.470001 -59.470001 0.594059 -426.793260 -292.078532; angle 3 4 11 42.765697 109.470001 ; abc 3 4 11 109.470001 -59.470001 0.594059 -292.078532 -426.793268; angle 3 4 12 42.765697 109.470001 ; abc 3 4 12 109.470001 -59.470001 0.594059 -292.078532 -426.793268; angle 3 4 5 53.319973 109.470001 ; abc 3 4 5 109.470001 -59.470001 0.594059 -292.078532 -292.078532; angle 11 4 12 40.843185 109.470001 ; abc 11 4 12 109.470001 -59.470001 0.594059 -426.793260 -426.793268; angle 11 4 5 42.765697 109.470001 ; abc 11 4 5 109.470001 -59.470001 0.594059 -426.793260 -292.078532; angle 12 4 5 42.765697 109.470001 ; abc 12 4 5 109.470001 -59.470001 0.594059 -426.793260 -292.078532; angle 1 5 4 71.983284 109.470001 ; abc 1 5 4 109.470001 -59.470001 0.594059 -435.632422 -292.078532; angle 1 5 13 59.553268 109.470001 ; abc 1 5 13 109.470001 -59.470001 0.594059 -435.632422 -426.793268; angle 1 5 14 59.553268 109.470001 ; abc 1 5 14 109.470001 -59.470001 0.594059 -435.632422 -426.793268; angle 4 5 13 42.765697 109.470001 ; abc 4 5 13 109.470001 -59.470001 0.594059 -292.078532 -426.793268; angle 4 5 14 42.765697 109.470001 ; abc 4 5 14 109.470001 -59.470001 0.594059 -292.078532 -426.793268; angle 13 5 14 40.843185 109.470001 ; abc 13 5 14 109.470001 -59.470001 0.594059 -426.793260 -426.793268; angle 2 6 15 42.765697 109.470001 ; abc 2 6 15 109.470001 -59.470001 0.594059 -292.078532 -426.793268; angle 2 6 16 42.765697 109.470001 ; abc 2 6 16 109.470001 -59.470001 0.594059 -292.078532 -426.793268; angle 2 6 7 61.862476 109.470001 ; abc 2 6 7 109.470001 -59.470001 0.594059 -292.078532 -359.647732; angle 15 6 16 40.843185 109.470001 ; abc 15 6 16 109.470001 -59.470001 0.594059 -426.793260 -426.793268; angle 15 6 7 50.548935 109.470001 ; abc 15 6 7 109.470001 -59.470001 0.594059 -426.793260 -359.647732; angle 16 6 7 50.548935 109.470001 ; abc 16 6 7 109.470001 -59.470001 0.594059 -426.793260 -359.647732; angle 6 7 17 52.647194 106.699997 ; angle 6 7 18 52.647194 106.699997 ; angle 17 7 18 53.160770 106.699997 ; torsion 5 1 2 8 0.053154 3 0.000000 ; torsion 5 1 2 6 0.053154 3 0.000000 ; torsion 5 1 2 3 0.053154 3 0.000000 ; torsion 2 1 5 4 0.053154 3 0.000000 ; torsion 2 1 5 13 0.053154 3 0.000000 ; torsion 2 1 5 14 0.053154 3 0.000000 ; torsion 1 2 6 15 0.235444 3 0.000000 ; torsion 1 2 6 16 0.235444 3 0.000000 ; torsion 1 2 6 7 0.235444 3 0.000000 ; torsion 8 2 6 15 0.235444 3 0.000000 ; torsion 8 2 6 16 0.235444 3 0.000000 ; torsion 8 2 6 7 0.235444 3 0.000000 ; torsion 3 2 6 15 0.235444 3 0.000000 ; torsion 3 2 6 16 0.235444 3 0.000000 ; torsion 3 2 6 7 0.235444 3 0.000000 ; torsion 1 2 3 9 0.235444 3 0.000000 ; torsion 1 2 3 10 0.235444 3 0.000000 ; torsion 1 2 3 4 0.235444 3 0.000000 ; torsion 8 2 3 9 0.235444 3 0.000000 ; torsion 8 2 3 10 0.235444 3 0.000000 ; torsion 8 2 3 4 0.235444 3 0.000000 ; torsion 6 2 3 9 0.235444 3 0.000000 ; torsion 6 2 3 10 0.235444 3 0.000000 ; torsion 6 2 3 4 0.235444 3 0.000000 ; torsion 2 3 4 11 0.235444 3 0.000000 ; torsion 2 3 4 12 0.235444 3 0.000000 ; torsion 2 3 4 5 0.235444 3 0.000000 ; torsion 9 3 4 11 0.235444 3 0.000000 ; torsion 9 3 4 12 0.235444 3 0.000000 ; torsion 9 3 4 5 0.235444 3 0.000000 ; torsion 10 3 4 11 0.235444 3 0.000000 ; torsion 10 3 4 12 0.235444 3 0.000000 ; torsion 10 3 4 5 0.235444 3 0.000000 ; torsion 3 4 5 1 0.235444 3 0.000000 ; torsion 3 4 5 13 0.235444 3 0.000000 ; torsion 3 4 5 14 0.235444 3 0.000000 ; torsion 11 4 5 1 0.235444 3 0.000000 ; torsion 11 4 5 13 0.235444 3 0.000000 ; torsion 11 4 5 14 0.235444 3 0.000000 ; torsion 12 4 5 1 0.235444 3 0.000000 ; torsion 12 4 5 13 0.235444 3 0.000000 ; torsion 12 4 5 14 0.235444 3 0.000000 ; torsion 2 6 7 17 0.162750 3 0.000000 ; torsion 2 6 7 18 0.162750 3 0.000000 ; torsion 15 6 7 17 0.162750 3 0.000000 ; torsion 15 6 7 18 0.162750 3 0.000000 ; torsion 16 6 7 17 0.162750 3 0.000000 ; torsion 16 6 7 18 0.162750 3 0.000000 ;