0 mol 48 unq 0 iso 0 dist 6.01454 13.2371 8.96621 12.665 8.94842 8.27973 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 6.01454 13.2371 8.96621 14.1985 9.9555 10.6228 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.02854 12.6371 9.45905 5.69691 8.5069 10.1894 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 7.41952 10.2713 7.62846 8.12985 8.0318 4.9582 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 6.6146 6.63999 9.46251 6.55381 8.48639 11.7023 numMergedOcc 0
5 mol 143 unq 0 iso 0 dist 6.68364 13.0852 8.99696 5.88056 5.44814 7.51335 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 9.71692 11.2206 6.58752 8.01366 8.3656 8.51158 numMergedOcc 0
7 mol 150 unq 0 iso 0 dist 9.73708 11.1844 6.62442 8.04136 8.44633 8.45996 numMergedOcc 0
8 mol 178 unq 0 iso 0 dist 6.25455 6.97067 5.71438 5.71 9.26238 12.035 numMergedOcc 0
9 mol 178 unq 1 iso 0 dist 8.14441 6.97067 7.69328 7.91652 7.97 12.0486 numMergedOcc 0
10 mol 178 unq 2 iso 0 dist 8.14441 6.97067 7.69328 11.8474 6.95432 13.4282 numMergedOcc 0
11 mol 178 unq 3 iso 0 dist 8.14441 6.97067 7.69328 5.71 9.32853 12.035 numMergedOcc 0
12 mol 183 unq 0 iso 0 dist 6.21267 3.97176 8.74697 5.49911 8.41645 4.59503 numMergedOcc 0
13 mol 183 unq 1 iso 0 dist 7.41743 11.2781 8.74697 10.5387 8.41645 4.59503 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 4.61671 5.88377 8.73468 8.06186 8.38813 4.76899 numMergedOcc 0
15 mol 218 unq 1 iso 0 dist 8.44004 7.38609 8.73468 7.45028 8.38813 4.76899 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 7.57712 6.555 9.58724 7.47274 7.27248 8.30031 numMergedOcc 0
17 mol 223 unq 0 iso 0 dist 5.75896 6.5658 7.22882 8.1388 5.50267 6.50937 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 7.62593 6.4556 5.90784 11.5075 8.96784 13.8957 numMergedOcc 0
19 mol 224 unq 1 iso 0 dist 7.62593 7.70922 8.50322 11.5075 8.96784 5.96427 numMergedOcc 0
20 mol 257 unq 0 iso 0 dist 8.98346 9.89359 6.75578 12.6474 5.81865 11.9011 numMergedOcc 0
21 mol 257 unq 1 iso 0 dist 8.98346 6.82943 9.29499 12.6474 5.81865 13.924 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 8.13696 10.2094 9.07261 7.37194 7.4261 13.8251 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 6.58277 4.56912 9.12381 12.6355 9.97206 14.5709 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 6.58277 8.89693 8.79148 12.6355 9.97206 13.1216 numMergedOcc 0
25 mol 266 unq 2 iso 0 dist 6.58277 14.5953 8.14167 12.6355 9.97206 11.0249 numMergedOcc 0
26 mol 266 unq 3 iso 0 dist 8.42706 5.43295 9.12381 16.8963 9.97206 14.5709 numMergedOcc 0
27 mol 266 unq 4 iso 0 dist 8.42706 7.37367 8.79148 16.8963 9.97206 13.1216 numMergedOcc 0
28 mol 266 unq 5 iso 0 dist 8.42706 15.7187 8.14167 16.8963 9.97206 11.0249 numMergedOcc 0
29 mol 266 unq 6 iso 0 dist 8.12204 15.9506 9.12381 5.85295 9.97206 14.5709 numMergedOcc 0
30 mol 266 unq 7 iso 0 dist 8.12204 14.4053 8.79148 5.85295 9.97206 13.1216 numMergedOcc 0
31 mol 266 unq 8 iso 0 dist 8.12204 5.69904 8.14167 5.85295 9.97206 11.0249 numMergedOcc 0
32 mol 273 unq 0 iso 0 dist 8.26333 12.9657 7.70185 10.4999 8.31704 5.15944 numMergedOcc 0
33 mol 273 unq 1 iso 0 dist 8.26333 12.6195 7.97117 10.4999 8.31704 5.35498 numMergedOcc 0
34 mol 279 unq 0 iso 0 dist 7.2783 8.57407 8.85972 6.83947 9.67649 5.10922 numMergedOcc 0
