$Number_of_Clusters = 33 $Seed = -1985 $Leader_Info 1 { Num_Members = 63 Total_Energy = 81.335 vdW = -29.701 Coulomb = -29.597 Internal = 140.633 rmsd = 0.000 } $Leader_Info 2 { Num_Members = 36 Total_Energy = 82.867 vdW = -29.277 Coulomb = -28.382 Internal = 140.526 rmsd = 1.012 } $Leader_Info 3 { Num_Members = 75 Total_Energy = 90.009 vdW = -25.537 Coulomb = -34.181 Internal = 149.727 rmsd = 2.770 } $Leader_Info 4 { Num_Members = 43 Total_Energy = 92.547 vdW = -20.019 Coulomb = -38.929 Internal = 151.495 rmsd = 2.810 } $Leader_Info 5 { Num_Members = 38 Total_Energy = 93.651 vdW = -26.908 Coulomb = -18.840 Internal = 139.398 rmsd = 3.109 } $Leader_Info 6 { Num_Members = 39 Total_Energy = 94.213 vdW = -18.700 Coulomb = -37.203 Internal = 150.116 rmsd = 1.687 } $Leader_Info 7 { Num_Members = 25 Total_Energy = 94.391 vdW = -24.353 Coulomb = -31.102 Internal = 149.846 rmsd = 1.502 } $Leader_Info 8 { Num_Members = 35 Total_Energy = 95.294 vdW = -24.553 Coulomb = -35.204 Internal = 155.051 rmsd = 3.043 } $Leader_Info 9 { Num_Members = 5 Total_Energy = 96.010 vdW = -27.719 Coulomb = -27.735 Internal = 151.464 rmsd = 1.151 } $Leader_Info 10 { Num_Members = 20 Total_Energy = 98.289 vdW = -16.551 Coulomb = -29.082 Internal = 143.923 rmsd = 1.210 } $Leader_Info 11 { Num_Members = 39 Total_Energy = 98.312 vdW = -29.256 Coulomb = -33.739 Internal = 161.307 rmsd = 2.036 } $Leader_Info 12 { Num_Members = 45 Total_Energy = 99.570 vdW = -18.318 Coulomb = -34.409 Internal = 152.297 rmsd = 2.227 } $Leader_Info 13 { Num_Members = 11 Total_Energy = 99.627 vdW = -19.764 Coulomb = -28.062 Internal = 147.452 rmsd = 3.115 } $Leader_Info 14 { Num_Members = 11 Total_Energy = 100.412 vdW = -20.771 Coulomb = -25.645 Internal = 146.828 rmsd = 2.256 } $Leader_Info 15 { Num_Members = 28 Total_Energy = 102.379 vdW = -23.319 Coulomb = -32.747 Internal = 158.444 rmsd = 2.097 } $Leader_Info 16 { Num_Members = 32 Total_Energy = 102.685 vdW = -21.218 Coulomb = -36.784 Internal = 160.686 rmsd = 2.699 } $Leader_Info 17 { Num_Members = 9 Total_Energy = 102.750 vdW = -20.960 Coulomb = -20.140 Internal = 143.850 rmsd = 2.838 } $Leader_Info 18 { Num_Members = 44 Total_Energy = 103.327 vdW = -23.333 Coulomb = -32.896 Internal = 159.557 rmsd = 2.962 } $Leader_Info 19 { Num_Members = 39 Total_Energy = 104.610 vdW = -16.090 Coulomb = -27.469 Internal = 148.168 rmsd = 3.653 } $Leader_Info 20 { Num_Members = 13 Total_Energy = 104.728 vdW = -22.250 Coulomb = -24.080 Internal = 151.059 rmsd = 1.148 } $Leader_Info 21 { Num_Members = 53 Total_Energy = 109.816 vdW = 8.494 Coulomb = -39.005 Internal = 140.327 rmsd = 3.023 } $Leader_Info 22 { Num_Members = 8 Total_Energy = 110.129 vdW = -25.731 Coulomb = -18.299 Internal = 154.159 rmsd = 1.309 } $Leader_Info 23 { Num_Members = 43 Total_Energy = 113.376 vdW = -19.496 Coulomb = -30.409 Internal = 163.281 rmsd = 1.622 } $Leader_Info 24 { Num_Members = 23 Total_Energy = 117.525 vdW = -10.004 Coulomb = -27.586 Internal = 155.114 rmsd = 1.894 } $Leader_Info 25 { Num_Members = 44 Total_Energy = 122.474 vdW = -18.755 Coulomb = -7.230 Internal = 148.459 rmsd = 3.372 } $Leader_Info 26 { Num_Members = 22 Total_Energy = 125.643 vdW = -24.607 Coulomb = -3.649 Internal = 153.899 rmsd = 1.791 } $Leader_Info 27 { Num_Members = 27 Total_Energy = 126.097 vdW = 17.290 Coulomb = -35.922 Internal = 144.729 rmsd = 2.262 } $Leader_Info 28 { Num_Members = 23 Total_Energy = 127.301 vdW = -25.046 Coulomb = -12.478 Internal = 164.824 rmsd = 1.819 } $Leader_Info 29 { Num_Members = 31 Total_Energy = 127.832 vdW = -3.308 Coulomb = -29.202 Internal = 160.342 rmsd = 3.437 } $Leader_Info 30 { Num_Members = 38 Total_Energy = 129.607 vdW = -3.252 Coulomb = -22.411 Internal = 155.270 rmsd = 3.402 } $Leader_Info 31 { Num_Members = 15 Total_Energy = 130.287 vdW = -9.119 Coulomb = -23.990 Internal = 163.396 rmsd = 3.276 } $Leader_Info 32 { Num_Members = 1 Total_Energy = 131.309 vdW = -18.585 Coulomb = -13.125 Internal = 163.019 rmsd = 3.592 } $Leader_Info 33 { Num_Members = 22 Total_Energy = 132.903 vdW = -6.958 Coulomb = -20.667 Internal = 160.528 rmsd = 3.812 }