# 0 1 0.8997670230155203 # itrj irand chiralcond
# 0 2 0.888283077955815 # itrj irand chiralcond
# 0 3 0.8675279843280307 # itrj irand chiralcond
# 0 4 0.8679008104614023 # itrj irand chiralcond
# 0 5 0.8647324335715463 # itrj irand chiralcond
# 0 6 0.8854424656132709 # itrj irand chiralcond
# 0 7 0.8902772446764718 # itrj irand chiralcond
# 0 8 0.8807265955754637 # itrj irand chiralcond
# 0 9 0.8806530145717533 # itrj irand chiralcond
# 0 10 0.8699537884622627 # itrj irand chiralcond
0 0.8795264438231538 # pbp Nr=10
# 5 1 0.9887203451078492 # itrj irand chiralcond
# 5 2 0.9504835441719351 # itrj irand chiralcond
# 5 3 0.9744318235652712 # itrj irand chiralcond
# 5 4 0.9039171130056395 # itrj irand chiralcond
# 5 5 0.9714905211645191 # itrj irand chiralcond
# 5 6 0.883771997361961 # itrj irand chiralcond
# 5 7 0.9911297224031665 # itrj irand chiralcond
# 5 8 0.9794198438662888 # itrj irand chiralcond
# 5 9 0.9277094879481179 # itrj irand chiralcond
# 5 10 1.0411313374238589 # itrj irand chiralcond
5 0.9612205736018609 # pbp Nr=10
