{"1": {
 "calculator": "vasp",
 "calculator_parameters": {},
 "cell": {"__ndarray__": [[3, 3], "float64", [10.19074863, 0.0, -0.979801375, 0.0, 13.791805087, 0.0, -0.977060378, 0.0, 11.874067371]]},
 "ctime": 20.602622220786486,
 "energy": -570.85334058,
 "forces": {"__ndarray__": [[84, 3], "float64", [-2.478676, 2.20572, 0.749385, -5.918954, 1.324633, -0.388936, -2.975808, 0.83656, 2.539049, -1.219227, 2.671891, -0.000165, 0.409621, 0.434997, 2.501414, -5.918954, -1.324633, -0.388936, 1.283152, 1.730326, 1.85648, -2.975808, -0.83656, 2.539049, -1.283152, 1.730326, -1.85648, 1.219227, 2.671891, 0.000165, -2.478676, -2.20572, 0.749385, -0.409621, 0.434997, -2.501414, 0.409621, -0.434997, 2.501414, 2.478676, 2.20572, -0.749385, -1.219227, -2.671891, -0.000165, 1.283152, -1.730326, 1.85648, 2.975808, 0.83656, -2.539049, -1.283152, -1.730326, -1.85648, -0.409621, -0.434997, -2.501414, 5.918954, 1.324633, 0.388936, 1.219227, -2.671891, 0.000165, 2.975808, -0.83656, -2.539049, 2.478676, -2.20572, -0.749385, 5.918954, -1.324633, 0.388936, -4.762605, -0.576284, -1.935513, 0.261089, -2.050603, -2.63194, 0.288939, 1.428133, 0.508963, -5.24025, -1.049185, -6.448294, -0.475404, 2.120845, 5.726189, -3.521659, -0.928726, 0.836521, 1.227159, 3.481674, -2.451733, -1.896376, 2.836795, -1.170174, 3.873281, 1.129998, 3.854499, -14.140027, -0.0, -4.089024, -3.828457, -1.684275, -0.597004, 0.261089, 2.050603, -2.63194, 1.839782, 1.37897, 3.694101, -2.102045, -0.386191, -3.87214, 0.288939, -1.428133, 0.508963, 10.526672, -0.0, 9.091793, -3.828457, 1.684275, -0.597004, -5.09289, 3.198848, 3.921467, -1.839782, 1.37897, -3.694101, -1.227159, 3.481674, 2.451733, -3.521659, 0.928726, 0.836521, -8.021928, -1.108301, -2.153866, 1.896376, 2.836795, 1.170174, -4.762605, 0.576284, -1.935513, 8.021928, -1.108301, 2.153866, 0.475404, 2.120845, -5.726189, -3.873281, 1.129998, -3.854499, -5.09289, -3.198848, 3.921467, -2.102045, 0.386191, -3.87214, -5.24025, 1.049185, -6.448294, 5.09289, 3.198848, -3.921467, 2.102045, -0.386191, 3.87214, -8.021928, 1.108301, -2.153866, 5.24025, -1.049185, 6.448294, 3.873281, -1.129998, 3.854499, -0.475404, -2.120845, 5.726189, 8.021928, 1.108301, 2.153866, 4.762605, -0.576284, 1.935513, -1.896376, -2.836795, -1.170174, 5.09289, -3.198848, -3.921467, 3.521659, -0.928726, -0.836521, -10.526672, -0.0, -9.091793, 1.227159, -3.481674, -2.451733, 3.828457, -1.684275, 0.597004, 1.839782, -1.37897, 3.694101, 2.102045, 0.386191, 3.87214, -0.288939, 1.428133, -0.508963, -1.839782, -1.37897, -3.694101, -3.873281, -1.129998, -3.854499, -0.261089, -2.050603, 2.63194, 3.828457, 1.684275, 0.597004, 1.896376, -2.836795, 1.170174, 14.140027, -0.0, 4.089024, -1.227159, -3.481674, 2.451733, -0.288939, -1.428133, -0.508963, 3.521659, 0.928726, -0.836521, 0.475404, -2.120845, -5.726189, 5.24025, 1.049185, 6.448294, 4.762605, 0.576284, 1.935513, -0.261089, 2.050603, 2.63194]]},
 "free_energy": -570.8533553,
 "key_value_pairs": {"perms_num": 4},
 "mtime": 25.58503527097795,
 "numbers": {"__ndarray__": [[84], "int32", [1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6]]},
 "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]},
 "positions": {"__ndarray__": [[84, 3], "float64", [2.2005, 10.13337, 7.69577, 0.448, 7.94263, 6.51232, 1.20201, 8.36679, 8.18215, 3.9221, 11.52802, 6.2678, 3.59712, 10.02039, 8.921, 0.448, 5.84917, 6.51232, 5.02217, 11.05309, 7.76628, 1.20201, 5.42501, 8.18215, 4.19152, 11.05309, 3.12799, 5.29159, 11.52802, 4.62647, 2.2005, 3.65843, 7.69577, 5.61657, 10.02039, 1.97327, 3.59712, 3.77141, 8.921, 7.01318, 10.13337, 3.19849, 3.9221, 2.26379, 6.2678, 5.02217, 2.73872, 7.76628, 8.01168, 8.36679, 2.71212, 4.19152, 2.73872, 3.12799, 5.61657, 3.77141, 1.97327, 8.76569, 7.94263, 4.38194, 5.29159, 2.26379, 4.62647, 8.01168, 5.42501, 2.71212, 7.01318, 3.65843, 3.19849, 8.76569, 5.84917, 4.38194, 2.74431, 9.3161, 7.39569, 1.36368, 7.66604, 6.33203, 1.93247, 8.10571, 7.53768, 2.72544, 9.30382, 5.11512, 3.18945, 9.71305, 6.12891, 1.92602, 8.23082, 5.18795, 4.22806, 10.55579, 6.09192, 3.3392, 9.36683, 3.91828, 3.859, 9.37035, 8.14147, 2.49211, 6.8959, 7.95998, 2.17884, 7.57025, 4.10271, 1.36368, 6.12576, 6.33203, 4.82198, 10.15169, 7.28936, 3.01314, 8.27646, 3.34663, 1.93247, 5.6861, 7.53768, 3.54064, 6.8959, 8.38776, 2.17884, 6.22155, 4.10271, 4.25037, 8.05482, 8.43901, 4.39171, 10.15169, 3.60491, 4.98563, 10.55579, 4.80234, 1.92602, 5.56099, 5.18795, 3.84658, 7.58269, 2.57787, 5.87448, 9.36683, 6.97599, 2.74431, 4.4757, 7.39569, 5.36711, 7.58269, 8.31639, 6.02424, 9.71305, 4.76535, 5.35469, 9.37035, 2.7528, 4.25037, 5.73698, 8.43901, 3.01314, 5.51535, 3.34663, 2.72544, 4.48798, 5.11512, 4.96332, 8.05482, 2.45526, 6.20055, 8.27646, 7.54763, 3.84658, 6.20911, 2.57787, 6.48825, 9.30382, 5.77914, 3.859, 4.42145, 8.14147, 3.18945, 4.07876, 6.12891, 5.36711, 6.20911, 8.31639, 6.46938, 9.3161, 3.49857, 3.3392, 4.42497, 3.91828, 4.96332, 5.73698, 2.45526, 7.28767, 8.23082, 5.70631, 5.67305, 6.8959, 2.50651, 4.22806, 3.23601, 6.09192, 7.03485, 7.57025, 6.79156, 4.82198, 3.64012, 7.28936, 6.20055, 5.51535, 7.54763, 7.28121, 8.10571, 3.35658, 4.39171, 3.64012, 3.60491, 5.35469, 4.42145, 2.7528, 7.85001, 7.66604, 4.56224, 7.03485, 6.22155, 6.79156, 5.87448, 4.42497, 6.97599, 6.72158, 6.8959, 2.93429, 4.98563, 3.23601, 4.80234, 7.28121, 5.6861, 3.35658, 7.28767, 5.56099, 5.70631, 6.02424, 4.07876, 4.76535, 6.48825, 4.48798, 5.77914, 6.46938, 4.4757, 3.49857, 7.85001, 6.12576, 4.56224]]},
 "stress": {"__ndarray__": [[6], "float64", [-0.2377592364378608, -0.14463933438517446, -0.17977310757173673, -0.0, -0.023801839013827656, -0.0]]},
 "unique_id": "d22e1c2de635554569dd700b1552c31b",
 "user": "mse-gucc"},
"ids": [1],
"nextid": 2}