$Number_of_Clusters = 36 $Seed = -1985 $Leader_Info 1 { Num_Members = 30 Total_Energy = 74.922 vdW = -26.153 Coulomb = -33.412 Internal = 134.487 rmsd = 0.000 } $Leader_Info 2 { Num_Members = 19 Total_Energy = 76.536 vdW = -25.804 Coulomb = -32.314 Internal = 134.653 rmsd = 1.131 } $Leader_Info 3 { Num_Members = 12 Total_Energy = 77.223 vdW = -19.335 Coulomb = -35.236 Internal = 131.794 rmsd = 1.227 } $Leader_Info 4 { Num_Members = 39 Total_Energy = 79.183 vdW = -23.498 Coulomb = -35.085 Internal = 137.765 rmsd = 3.549 } $Leader_Info 5 { Num_Members = 39 Total_Energy = 79.570 vdW = -27.182 Coulomb = -31.294 Internal = 138.045 rmsd = 3.296 } $Leader_Info 6 { Num_Members = 45 Total_Energy = 81.951 vdW = -25.198 Coulomb = -35.302 Internal = 142.451 rmsd = 3.090 } $Leader_Info 7 { Num_Members = 43 Total_Energy = 82.527 vdW = -26.649 Coulomb = -37.083 Internal = 146.260 rmsd = 1.604 } $Leader_Info 8 { Num_Members = 34 Total_Energy = 83.315 vdW = -24.014 Coulomb = -29.612 Internal = 136.941 rmsd = 1.480 } $Leader_Info 9 { Num_Members = 48 Total_Energy = 84.913 vdW = -22.625 Coulomb = -35.632 Internal = 143.169 rmsd = 1.913 } $Leader_Info 10 { Num_Members = 43 Total_Energy = 84.974 vdW = -21.181 Coulomb = -38.639 Internal = 144.794 rmsd = 1.735 } $Leader_Info 11 { Num_Members = 23 Total_Energy = 85.203 vdW = -23.470 Coulomb = -33.478 Internal = 142.151 rmsd = 3.118 } $Leader_Info 12 { Num_Members = 37 Total_Energy = 87.864 vdW = -29.686 Coulomb = -28.041 Internal = 145.590 rmsd = 1.447 } $Leader_Info 13 { Num_Members = 41 Total_Energy = 88.674 vdW = -27.886 Coulomb = -27.694 Internal = 144.255 rmsd = 11.289 } $Leader_Info 14 { Num_Members = 37 Total_Energy = 88.962 vdW = -16.473 Coulomb = -33.626 Internal = 139.062 rmsd = 3.473 } $Leader_Info 15 { Num_Members = 41 Total_Energy = 89.148 vdW = -20.675 Coulomb = -35.677 Internal = 145.500 rmsd = 2.144 } $Leader_Info 16 { Num_Members = 3 Total_Energy = 91.064 vdW = -26.094 Coulomb = -27.470 Internal = 144.628 rmsd = 1.346 } $Leader_Info 17 { Num_Members = 16 Total_Energy = 92.641 vdW = -26.995 Coulomb = -33.873 Internal = 153.509 rmsd = 3.235 } $Leader_Info 18 { Num_Members = 31 Total_Energy = 93.228 vdW = -18.526 Coulomb = -35.228 Internal = 146.982 rmsd = 3.179 } $Leader_Info 19 { Num_Members = 36 Total_Energy = 94.603 vdW = -23.135 Coulomb = -33.482 Internal = 151.221 rmsd = 2.812 } $Leader_Info 20 { Num_Members = 41 Total_Energy = 96.564 vdW = -25.865 Coulomb = -25.628 Internal = 148.057 rmsd = 11.596 } $Leader_Info 21 { Num_Members = 1 Total_Energy = 96.634 vdW = -22.669 Coulomb = -30.404 Internal = 149.707 rmsd = 3.035 } $Leader_Info 22 { Num_Members = 1 Total_Energy = 96.717 vdW = -26.274 Coulomb = -31.803 Internal = 154.794 rmsd = 2.204 } $Leader_Info 23 { Num_Members = 47 Total_Energy = 98.073 vdW = -16.500 Coulomb = -36.670 Internal = 151.243 rmsd = 3.532 } $Leader_Info 24 { Num_Members = 44 Total_Energy = 98.204 vdW = -21.199 Coulomb = -35.029 Internal = 154.432 rmsd = 3.796 } $Leader_Info 25 { Num_Members = 42 Total_Energy = 101.436 vdW = -24.040 Coulomb = -21.657 Internal = 147.133 rmsd = 2.053 } $Leader_Info 26 { Num_Members = 10 Total_Energy = 101.775 vdW = -17.728 Coulomb = -29.241 Internal = 148.744 rmsd = 2.218 } $Leader_Info 27 { Num_Members = 1 Total_Energy = 101.951 vdW = -10.186 Coulomb = -32.580 Internal = 144.718 rmsd = 2.868 } $Leader_Info 28 { Num_Members = 38 Total_Energy = 102.890 vdW = -12.247 Coulomb = -37.586 Internal = 152.723 rmsd = 2.735 } $Leader_Info 29 { Num_Members = 34 Total_Energy = 104.587 vdW = -22.423 Coulomb = -25.148 Internal = 152.158 rmsd = 11.257 } $Leader_Info 30 { Num_Members = 1 Total_Energy = 105.574 vdW = -10.510 Coulomb = -26.527 Internal = 142.611 rmsd = 1.401 } $Leader_Info 31 { Num_Members = 6 Total_Energy = 106.121 vdW = -16.148 Coulomb = -33.121 Internal = 155.390 rmsd = 3.374 } $Leader_Info 32 { Num_Members = 25 Total_Energy = 107.253 vdW = -3.691 Coulomb = -38.507 Internal = 149.451 rmsd = 3.596 } $Leader_Info 33 { Num_Members = 28 Total_Energy = 110.920 vdW = -19.750 Coulomb = -33.906 Internal = 164.576 rmsd = 2.786 } $Leader_Info 34 { Num_Members = 39 Total_Energy = 111.092 vdW = -13.152 Coulomb = -21.885 Internal = 146.129 rmsd = 3.300 } $Leader_Info 35 { Num_Members = 23 Total_Energy = 111.711 vdW = -8.480 Coulomb = -37.374 Internal = 157.565 rmsd = 1.818 } $Leader_Info 36 { Num_Members = 2 Total_Energy = 115.107 vdW = 5.591 Coulomb = -31.311 Internal = 140.826 rmsd = 1.737 }