0 mol 1 unq 0 iso 0 dist 5.87976 8.83387 4.93091 4.49401 7.21349 8.15672 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.71167 9.85305 4.93091 5.72763 7.21349 8.15672 numMergedOcc 0
2 mol 2 unq 0 iso 0 dist 5.69072 7.60935 6.93149 6.99962 5.42021 9.78005 numMergedOcc 0
3 mol 2 unq 1 iso 0 dist 5.69072 7.60935 6.93149 10.5809 9.15006 12.2141 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 7.19406 7.12713 9.83606 11.4401 9.14996 10.887 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.99618 6.45955 9.93156 6.70013 9.4022 12.6795 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 7.18358 6.29801 5.73969 8.97165 7.74131 10.2786 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 7.33521 9.57352 6.41397 9.94542 8.00003 13.9426 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 6.28645 9.00481 7.1034 9.33151 9.64281 14.8951 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 5.99873 8.18193 6.83136 4.64006 8.53731 10.546 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.08733 6.66313 3.80816 10.6776 7.72434 10.6073 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 4.90449 6.3646 3.80816 5.90092 7.72434 10.6073 numMergedOcc 0
12 mol 120 unq 0 iso 0 dist 9.35529 8.31527 8.9188 9.0362 8.43293 11.0505 numMergedOcc 0
13 mol 120 unq 1 iso 0 dist 9.35529 7.64841 3.71884 9.0362 8.43293 8.03124 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 6.57161 9.3206 7.16323 9.48174 9.83308 15.1025 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 6.57161 9.3206 7.16323 8.6142 8.97159 14.5779 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 7.7195 6.80203 11.244 12.6444 8.59783 13.457 numMergedOcc 0
17 mol 171 unq 1 iso 0 dist 8.30819 8.00826 11.244 7.0159 8.59783 13.457 numMergedOcc 0
18 mol 185 unq 0 iso 0 dist 9.27825 9.62449 5.80135 12.1385 9.56016 8.07469 numMergedOcc 0
19 mol 185 unq 1 iso 0 dist 9.27825 9.62449 5.80135 13.9145 7.92501 12.7168 numMergedOcc 0
20 mol 187 unq 0 iso 0 dist 8.45366 8.26077 3.86201 14.6085 7.81168 11.1483 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 7.11262 7.22151 6.59432 10.8267 8.99496 10.9951 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 6.84909 7.61675 8.93255 12.2904 8.35169 13.5939 numMergedOcc 0
23 mol 292 unq 1 iso 0 dist 6.38051 4.97488 5.55248 10.7243 9.87259 13.0608 numMergedOcc 0
24 mol 292 unq 2 iso 0 dist 6.38051 4.97488 5.55248 4.49811 7.7557 9.01115 numMergedOcc 0
