0 mol 19 unq 0 iso 0 dist 8.18518 14.1404 8.4674 6.57145 4.54938 7.67038 12.8718 9.74255 8.40416 7.75618 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.18518 14.1404 8.4674 6.01189 7.82074 10.3915 12.8718 9.74255 8.40416 12.3215 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 8.18518 6.57145 4.54938 14.1404 8.4674 7.67038 12.8718 9.74255 7.75618 8.40416 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 8.18518 6.57145 4.54938 6.01189 7.82074 5.03957 12.8718 9.74255 7.75618 12.3215 numMergedOcc 0
4 mol 60 unq 0 iso 0 dist 8.8058 10.0675 8.7531 5.09908 8.33063 7.29309 8.04272 7.04075 9.90939 10.5084 numMergedOcc 0
5 mol 60 unq 1 iso 0 dist 8.8058 10.0675 8.7531 12.5818 6.43294 5.67502 8.04272 7.04075 9.90939 10.1323 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.79954 12.8388 9.96396 14.1415 9.38498 15.7123 6.66506 5.11416 9.24757 13.8696 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 5.79954 12.8388 9.96396 9.65653 9.75218 12.016 6.66506 5.11416 9.24757 13.0145 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 7.01889 15.0744 9.96396 7.9573 9.38498 15.7123 11.8962 5.11416 9.24757 13.8696 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 7.01889 15.0744 9.96396 8.11922 9.75218 12.016 11.8962 5.11416 9.24757 13.0145 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 9.22376 5.75796 7.47541 3.85308 7.66905 5.42586 14.407 13.5116 9.82915 12.0078 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 9.22376 5.75796 7.47541 9.77828 5.73196 6.87425 14.407 13.5116 9.82915 14.4382 numMergedOcc 0
12 mol 85 unq 2 iso 0 dist 9.22376 3.85308 7.66905 5.75796 7.47541 5.42586 9.04728 4.65335 7.54568 10.0796 numMergedOcc 0
13 mol 85 unq 3 iso 0 dist 9.22376 3.85308 7.66905 9.77828 5.73196 10.1164 9.04728 4.65335 7.54568 9.39864 numMergedOcc 0
14 mol 85 unq 4 iso 0 dist 9.22376 9.77828 5.73196 5.75796 7.47541 6.87425 9.04728 4.65335 9.39864 10.0796 numMergedOcc 0
15 mol 85 unq 5 iso 0 dist 9.22376 9.77828 5.73196 3.85308 7.66905 10.1164 9.04728 4.65335 9.39864 7.54568 numMergedOcc 0
16 mol 95 unq 0 iso 0 dist 9.40559 11.8978 8.03644 13.018 7.27724 8.41707 19.4788 11.4333 9.49454 12.1092 numMergedOcc 0
17 mol 115 unq 0 iso 0 dist 8.35604 5.3967 5.11551 11.9798 7.11972 6.5838 11.0607 6.77806 6.92026 5.88249 numMergedOcc 0
18 mol 115 unq 1 iso 0 dist 8.35604 11.9798 7.11972 5.3967 5.11551 6.5838 11.0607 6.77806 5.88249 6.92026 numMergedOcc 0
19 mol 115 unq 2 iso 0 dist 7.83568 7.10772 5.11551 11.3906 7.11972 6.5838 13.3321 6.77806 6.92026 5.88249 numMergedOcc 0
20 mol 115 unq 3 iso 0 dist 7.83568 11.3906 7.11972 7.10772 5.11551 6.5838 13.3321 6.77806 5.88249 6.92026 numMergedOcc 0
21 mol 134 unq 0 iso 0 dist 5.67862 9.52819 6.37586 12.4156 9.71307 6.81259 10.8422 5.29786 6.23142 9.94764 numMergedOcc 0
22 mol 134 unq 1 iso 0 dist 5.67862 12.4156 9.71307 9.52819 6.37586 6.81259 10.8422 5.29786 9.94764 6.23142 numMergedOcc 0
23 mol 134 unq 2 iso 0 dist 7.97208 12.5576 6.54501 9.52819 6.49416 5.00526 10.8422 5.71679 7.69991 6.23142 numMergedOcc 0
24 mol 134 unq 3 iso 0 dist 7.97208 9.52819 6.49416 12.5576 6.54501 5.00526 10.8422 5.71679 6.23142 7.69991 numMergedOcc 0
25 mol 175 unq 0 iso 0 dist 6.6776 7.42609 6.57069 13.7028 9.0018 8.16421 8.79832 8.29015 9.77896 10.4182 numMergedOcc 0
26 mol 175 unq 1 iso 0 dist 6.6776 7.42609 6.57069 10.4662 5.6234 5.35493 8.79832 8.29015 9.77896 11.6765 numMergedOcc 0
27 mol 204 unq 0 iso 0 dist 7.7292 9.54287 8.51516 13.4646 7.10633 10.8344 8.82861 5.86489 7.32294 11.5776 numMergedOcc 0
28 mol 220 unq 0 iso 0 dist 8.9077 10.6943 9.23153 15.396 8.24498 10.5449 7.46122 7.11498 6.59716 13.1498 numMergedOcc 0
29 mol 231 unq 0 iso 0 dist 9.98232 10.9863 7.37839 10.2117 8.40182 4.06055 13.7652 6.37275 6.98875 6.54852 numMergedOcc 0
30 mol 231 unq 1 iso 0 dist 9.98232 10.2117 8.40182 10.9863 7.37839 4.06055 13.7652 6.37275 6.54852 6.98875 numMergedOcc 0
