0 mol 11 unq 0 iso 0 dist 9.76233 13.4378 9.81983 19.2831 12.3213 7.05626 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 6.19695 5.00898 6.31608 8.71235 4.21233 5.94245 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.80453 6.0363 9.42099 8.9175 3.42062 8.16033 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 9.92412 6.89052 8.19958 12.8818 4.79316 8.69565 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 9.00481 7.02101 7.40338 14.0459 16.4052 9.17878 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 5.56913 6.85703 6.5788 8.56221 3.65999 9.40308 numMergedOcc 0
6 mol 117 unq 1 iso 0 dist 5.56913 9.39186 6.2771 8.56221 3.65999 8.00497 numMergedOcc 0
7 mol 182 unq 0 iso 0 dist 8.10542 13.7302 9.98182 20.141 14.9932 9.38111 numMergedOcc 0
8 mol 182 unq 1 iso 0 dist 6.78641 5.41536 9.98182 14.0229 14.9932 9.38111 numMergedOcc 0
9 mol 193 unq 0 iso 0 dist 9.28442 14.5516 9.9042 13.9845 5.57164 6.77983 numMergedOcc 0
10 mol 193 unq 1 iso 0 dist 9.28442 11.2251 6.21262 13.9845 5.57164 7.06538 numMergedOcc 0
11 mol 249 unq 0 iso 0 dist 5.3865 5.56847 8.76518 5.98732 3.89698 6.7282 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 7.22473 4.48112 6.49413 12.3039 7.27279 8.75324 numMergedOcc 0
13 mol 260 unq 1 iso 0 dist 6.02628 4.48112 6.12343 12.3039 9.87974 8.75324 numMergedOcc 0
14 mol 260 unq 2 iso 0 dist 7.13397 5.72956 6.49413 7.69551 7.27279 8.75324 numMergedOcc 0
15 mol 260 unq 3 iso 0 dist 5.33278 5.72956 4.52405 7.69551 5.97575 8.75324 numMergedOcc 0
16 mol 281 unq 0 iso 0 dist 8.78416 13.7467 6.18742 9.79394 3.86368 6.67593 numMergedOcc 0
17 mol 281 unq 1 iso 0 dist 9.22428 13.7467 6.8089 9.79394 7.4282 6.67593 numMergedOcc 0
18 mol 281 unq 2 iso 0 dist 7.82358 12.8593 6.18742 6.52115 3.86368 6.67593 numMergedOcc 0
19 mol 281 unq 3 iso 0 dist 7.95687 13.7172 6.8089 14.9358 7.4282 6.67593 numMergedOcc 0
