0 mol 92 unq 0 iso 0 dist 7.70527 8.15367 10.9389 11.9657 15.2012 8.36431 numMergedOcc 0
1 mol 100 unq 0 iso 0 dist 9.84449 9.82043 4.71183 5.2995 7.689 6.58204 numMergedOcc 0
2 mol 100 unq 1 iso 0 dist 9.84449 9.82043 4.71183 7.58985 11.1764 7.75343 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 9.29626 5.60716 4.41423 5.56084 10.4101 6.87861 numMergedOcc 0
4 mol 115 unq 1 iso 0 dist 9.29626 5.60716 4.41423 5.71451 9.32559 6.50039 numMergedOcc 0
5 mol 115 unq 2 iso 0 dist 6.42762 5.52706 5.13314 6.98664 9.21474 6.87861 numMergedOcc 0
6 mol 115 unq 3 iso 0 dist 6.42762 5.52706 5.13314 5.889 9.70616 6.50039 numMergedOcc 0
7 mol 127 unq 0 iso 0 dist 8.59279 8.20636 8.53498 6.93078 12.6241 6.192 numMergedOcc 0
8 mol 127 unq 1 iso 0 dist 8.59279 8.20636 8.53498 10.6558 14.9222 7.69308 numMergedOcc 0
9 mol 127 unq 2 iso 0 dist 8.59279 8.20636 8.53498 16.0489 15.9068 8.59981 numMergedOcc 0
10 mol 127 unq 3 iso 0 dist 8.59279 8.20636 8.53498 12.8217 14.1377 7.66331 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 8.00919 8.25207 12.398 14.4683 20.0949 7.92688 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 5.6184 6.84347 7.90465 12.1089 16.1798 9.31887 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 8.63031 9.23118 8.35848 5.40949 10.8493 6.73313 numMergedOcc 0
14 mol 227 unq 0 iso 0 dist 9.51432 8.11377 5.42723 5.70988 9.79656 9.62609 numMergedOcc 0
15 mol 227 unq 1 iso 0 dist 9.34888 8.11377 9.72888 5.70988 9.02226 9.62609 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 8.74649 8.60471 6.81993 5.47633 10.471 9.58736 numMergedOcc 0
17 mol 235 unq 1 iso 0 dist 8.74649 8.60471 6.81993 10.2835 15.1174 9.43058 numMergedOcc 0
18 mol 235 unq 2 iso 0 dist 8.74649 8.60471 6.81993 12.4425 15.145 8.75735 numMergedOcc 0
19 mol 235 unq 3 iso 0 dist 8.74649 8.60471 6.81993 15.2767 10.6239 6.98084 numMergedOcc 0
20 mol 235 unq 4 iso 0 dist 8.74649 8.60471 6.81993 11.9322 8.69551 7.32211 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 8.27284 9.67417 7.37771 10.0289 10.1878 9.0012 numMergedOcc 0
