0 mol 24 unq 0 iso 0 dist 6.32779 7.63824 5.43498 6.09311 9.74777 12.7806 11.6096 10.3017 5.9372 15.7269 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.32779 7.63824 5.43498 6.09311 9.74777 12.7806 10.8208 9.05162 6.93597 13.4969 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.38139 6.77802 5.7037 3.42062 9.07283 9.05737 4.31769 10.1237 8.40186 7.06935 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 8.38139 9.07283 3.42062 5.7037 6.77802 9.05737 7.16993 8.16033 9.42099 3.85506 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 7.52742 8.15861 7.14242 3.81285 6.56288 6.67137 4.32784 10.6441 8.04853 5.22259 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 7.52742 8.15861 7.14242 6.17121 5.97559 7.04244 4.32784 10.6441 8.04853 7.66499 numMergedOcc 0
6 mol 85 unq 2 iso 0 dist 7.52742 6.56288 3.81285 7.14242 8.15861 6.67137 14.0998 12.1571 9.13593 13.6534 numMergedOcc 0
7 mol 85 unq 3 iso 0 dist 7.52742 6.56288 3.81285 15.6495 9.27814 12.9252 14.0998 12.1571 9.13593 19.3305 numMergedOcc 0
8 mol 85 unq 4 iso 0 dist 7.52742 5.97559 6.17121 7.14242 8.15861 7.04244 14.0998 12.1571 8.25144 13.6534 numMergedOcc 0
9 mol 85 unq 5 iso 0 dist 7.52742 5.97559 6.17121 15.6495 9.27814 15.2807 14.0998 12.1571 8.25144 19.3305 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 5.27541 5.96189 3.99275 13.113 8.61597 11.5475 6.45786 6.70158 7.48947 14.19 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 9.00874 8.92653 3.27874 8.70619 8.23294 5.20429 6.87756 7.24843 5.56839 5.01255 numMergedOcc 0
12 mol 93 unq 2 iso 0 dist 9.00874 8.92653 3.27874 8.70619 8.23294 5.20429 5.82092 7.63783 7.83506 8.98901 numMergedOcc 0
13 mol 93 unq 3 iso 0 dist 9.00874 8.92653 3.27874 3.89959 8.2702 8.71366 6.87756 7.24843 5.56839 9.11323 numMergedOcc 0
14 mol 93 unq 4 iso 0 dist 9.00874 8.92653 3.27874 3.89959 8.2702 8.71366 5.82092 7.63783 7.83506 8.52329 numMergedOcc 0
15 mol 111 unq 0 iso 0 dist 5.68841 6.33923 7.42165 3.83194 8.51084 4.91212 12.6461 16.5492 9.72371 8.83426 numMergedOcc 0
16 mol 111 unq 1 iso 0 dist 5.68841 6.33923 7.42165 5.56913 5.53271 9.34782 12.6461 16.5492 9.72371 16.815 numMergedOcc 0
17 mol 124 unq 0 iso 0 dist 7.24083 8.06631 6.49874 11.7364 9.01881 10.1188 4.31676 10.1598 8.65859 11.5547 numMergedOcc 0
18 mol 281 unq 0 iso 0 dist 9.18565 9.05453 3.86368 16.2801 7.43535 7.90368 14.815 6.67593 6.18742 3.78169 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 5.06731 6.05363 3.76412 6.00938 8.15636 10.5724 14.8133 12.182 9.23152 19.7934 numMergedOcc 0
20 mol 287 unq 1 iso 0 dist 5.06731 6.05363 3.76412 4.88961 7.86292 9.98932 14.8133 12.182 9.23152 17.9778 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 5.06731 6.05363 3.76412 6.00938 8.15636 10.5724 14.8133 12.182 9.23152 19.7934 numMergedOcc 0
22 mol 288 unq 1 iso 0 dist 5.06731 6.05363 3.76412 4.88961 7.86292 9.98932 14.8133 12.182 9.23152 17.9778 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 5.06731 6.05363 3.76412 6.00938 8.15636 10.5724 14.8133 12.182 9.23152 19.7934 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 5.06731 6.05363 3.76412 4.88961 7.86292 9.98932 14.8133 12.182 9.23152 17.9778 numMergedOcc 0
