0 mol 37 unq 0 iso 0 dist 7.489 4.24987 6.64605 6.18594 8.26833 9.6756 numMergedOcc 0
1 mol 37 unq 1 iso 0 dist 7.489 4.24987 6.64605 8.79391 8.80149 9.26751 numMergedOcc 0
2 mol 81 unq 0 iso 0 dist 8.68497 11.4303 5.96486 6.61128 7.41802 6.15601 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 9.04648 5.07022 7.97999 15.069 7.88704 13.7016 numMergedOcc 0
4 mol 83 unq 1 iso 0 dist 9.04648 5.07022 7.97999 5.04995 9.54782 9.41602 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 8.28452 6.68968 9.64281 10.03 9.15172 13.0381 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 8.44004 12.1395 9.64281 3.97916 9.15172 13.0381 numMergedOcc 0
7 mol 244 unq 0 iso 0 dist 7.00974 8.30584 5.06669 12.6177 8.19381 8.71894 numMergedOcc 0
8 mol 244 unq 1 iso 0 dist 7.00974 8.30584 5.06669 11.5282 8.93421 7.94286 numMergedOcc 0
9 mol 244 unq 2 iso 0 dist 7.00974 8.30584 5.06669 12.6014 7.35657 5.36127 numMergedOcc 0
10 mol 244 unq 3 iso 0 dist 7.00974 8.30584 5.06669 5.30507 6.19605 6.81518 numMergedOcc 0
11 mol 244 unq 4 iso 0 dist 7.00974 4.39303 5.65248 12.6177 8.19381 8.52699 numMergedOcc 0
12 mol 244 unq 5 iso 0 dist 7.00974 4.39303 5.65248 11.5282 8.93421 12.4452 numMergedOcc 0
13 mol 244 unq 6 iso 0 dist 7.00974 4.39303 5.65248 12.6014 7.35657 11.2736 numMergedOcc 0
14 mol 244 unq 7 iso 0 dist 7.00974 4.39303 5.65248 5.30507 6.19605 7.59011 numMergedOcc 0
15 mol 247 unq 0 iso 0 dist 9.79737 3.80357 9.65548 12.8215 7.85081 12.2609 numMergedOcc 0
16 mol 247 unq 1 iso 0 dist 9.79737 8.72908 8.05213 12.8215 7.85081 5.57603 numMergedOcc 0
17 mol 247 unq 2 iso 0 dist 9.79737 16.8289 8.67304 12.8215 7.85081 8.53302 numMergedOcc 0
18 mol 247 unq 3 iso 0 dist 8.34155 6.64203 9.65548 11.7575 7.85081 12.2609 numMergedOcc 0
19 mol 247 unq 4 iso 0 dist 8.34155 8.21392 8.05213 11.7575 7.85081 5.57603 numMergedOcc 0
20 mol 247 unq 5 iso 0 dist 8.34155 10.4393 8.67304 11.7575 7.85081 8.53302 numMergedOcc 0
21 mol 247 unq 6 iso 0 dist 8.30945 10.5234 9.65548 9.93257 7.85081 12.2609 numMergedOcc 0
22 mol 247 unq 7 iso 0 dist 8.30945 8.43499 8.05213 9.93257 7.85081 5.57603 numMergedOcc 0
23 mol 247 unq 8 iso 0 dist 8.30945 6.13686 8.67304 9.93257 7.85081 8.53302 numMergedOcc 0
24 mol 256 unq 0 iso 0 dist 9.36652 13.4771 7.14598 15.6445 8.88264 4.19031 numMergedOcc 0
25 mol 256 unq 1 iso 0 dist 7.54613 9.58759 7.14598 11.974 8.88264 4.19031 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 8.62592 8.95242 8.37512 5.06393 6.41167 5.76241 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 6.83706 11.3955 5.30455 8.59148 9.03983 9.69102 numMergedOcc 0
28 mol 259 unq 1 iso 0 dist 6.83706 9.8442 6.8184 8.59148 9.03983 4.76806 numMergedOcc 0
29 mol 283 unq 0 iso 0 dist 8.28068 5.70683 8.36393 5.72409 5.96202 7.50871 numMergedOcc 0
30 mol 294 unq 0 iso 0 dist 8.88961 3.86056 8.89372 7.5022 6.33332 5.39342 numMergedOcc 0
