$Number_of_Clusters = 33 $Seed = -1985 $Leader_Info 1 { Num_Members = 32 Total_Energy = 83.449 vdW = -17.403 Coulomb = -32.437 Internal = 133.289 rmsd = 0.000 } $Leader_Info 2 { Num_Members = 38 Total_Energy = 83.616 vdW = -25.680 Coulomb = -33.131 Internal = 142.427 rmsd = 3.479 } $Leader_Info 3 { Num_Members = 47 Total_Energy = 86.707 vdW = -23.989 Coulomb = -33.021 Internal = 143.717 rmsd = 3.569 } $Leader_Info 4 { Num_Members = 44 Total_Energy = 87.889 vdW = -27.468 Coulomb = -34.177 Internal = 149.534 rmsd = 3.076 } $Leader_Info 5 { Num_Members = 48 Total_Energy = 87.941 vdW = -28.464 Coulomb = -32.113 Internal = 148.518 rmsd = 1.940 } $Leader_Info 6 { Num_Members = 65 Total_Energy = 89.479 vdW = -25.080 Coulomb = -32.400 Internal = 146.960 rmsd = 1.555 } $Leader_Info 7 { Num_Members = 40 Total_Energy = 92.385 vdW = -10.852 Coulomb = -37.306 Internal = 140.543 rmsd = 3.168 } $Leader_Info 8 { Num_Members = 31 Total_Energy = 93.678 vdW = -17.751 Coulomb = -31.711 Internal = 143.140 rmsd = 3.313 } $Leader_Info 9 { Num_Members = 20 Total_Energy = 93.822 vdW = -25.996 Coulomb = -33.702 Internal = 153.520 rmsd = 3.333 } $Leader_Info 10 { Num_Members = 12 Total_Energy = 94.513 vdW = -12.496 Coulomb = -35.266 Internal = 142.274 rmsd = 3.831 } $Leader_Info 11 { Num_Members = 62 Total_Energy = 95.955 vdW = -27.440 Coulomb = -30.509 Internal = 153.905 rmsd = 2.248 } $Leader_Info 12 { Num_Members = 20 Total_Energy = 96.396 vdW = -24.801 Coulomb = -30.688 Internal = 151.885 rmsd = 3.105 } $Leader_Info 13 { Num_Members = 32 Total_Energy = 98.651 vdW = -20.002 Coulomb = -27.330 Internal = 145.984 rmsd = 1.837 } $Leader_Info 14 { Num_Members = 44 Total_Energy = 100.799 vdW = -16.595 Coulomb = -32.352 Internal = 149.746 rmsd = 2.046 } $Leader_Info 15 { Num_Members = 2 Total_Energy = 100.809 vdW = -15.019 Coulomb = -33.306 Internal = 149.135 rmsd = 3.514 } $Leader_Info 16 { Num_Members = 42 Total_Energy = 101.277 vdW = -17.429 Coulomb = -31.850 Internal = 150.556 rmsd = 2.524 } $Leader_Info 17 { Num_Members = 12 Total_Energy = 101.928 vdW = -16.977 Coulomb = -18.294 Internal = 137.198 rmsd = 3.585 } $Leader_Info 18 { Num_Members = 27 Total_Energy = 103.102 vdW = -13.237 Coulomb = -31.675 Internal = 148.014 rmsd = 2.467 } $Leader_Info 19 { Num_Members = 34 Total_Energy = 104.123 vdW = -12.112 Coulomb = -33.728 Internal = 149.963 rmsd = 2.846 } $Leader_Info 20 { Num_Members = 48 Total_Energy = 104.820 vdW = -0.943 Coulomb = -41.276 Internal = 147.038 rmsd = 2.566 } $Leader_Info 21 { Num_Members = 23 Total_Energy = 105.388 vdW = -19.107 Coulomb = -30.127 Internal = 154.621 rmsd = 3.622 } $Leader_Info 22 { Num_Members = 35 Total_Energy = 106.076 vdW = -28.085 Coulomb = -13.452 Internal = 147.613 rmsd = 3.266 } $Leader_Info 23 { Num_Members = 27 Total_Energy = 106.622 vdW = -17.100 Coulomb = -29.140 Internal = 152.862 rmsd = 4.056 } $Leader_Info 24 { Num_Members = 40 Total_Energy = 110.641 vdW = -17.347 Coulomb = -27.881 Internal = 155.869 rmsd = 3.009 } $Leader_Info 25 { Num_Members = 22 Total_Energy = 113.963 vdW = -5.235 Coulomb = -34.042 Internal = 153.241 rmsd = 2.882 } $Leader_Info 26 { Num_Members = 46 Total_Energy = 117.545 vdW = -18.091 Coulomb = -14.571 Internal = 150.207 rmsd = 3.735 } $Leader_Info 27 { Num_Members = 38 Total_Energy = 117.615 vdW = -16.139 Coulomb = -23.285 Internal = 157.039 rmsd = 3.405 } $Leader_Info 28 { Num_Members = 27 Total_Energy = 117.922 vdW = -14.855 Coulomb = -28.196 Internal = 160.973 rmsd = 1.621 } $Leader_Info 29 { Num_Members = 4 Total_Energy = 120.413 vdW = -21.044 Coulomb = -12.208 Internal = 153.666 rmsd = 3.589 } $Leader_Info 30 { Num_Members = 14 Total_Energy = 121.695 vdW = -6.724 Coulomb = -34.036 Internal = 162.455 rmsd = 3.256 } $Leader_Info 31 { Num_Members = 20 Total_Energy = 122.444 vdW = -11.592 Coulomb = -8.365 Internal = 142.402 rmsd = 2.173 } $Leader_Info 32 { Num_Members = 2 Total_Energy = 125.353 vdW = -10.816 Coulomb = -33.821 Internal = 169.991 rmsd = 3.959 } $Leader_Info 33 { Num_Members = 2 Total_Energy = 125.939 vdW = -7.142 Coulomb = -29.389 Internal = 162.470 rmsd = 3.832 }