0 mol 34 unq 0 iso 0 dist 8.11297 4.20721 7.5203 5.55764 5.80848 6.44158 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 8.23001 7.4251 6.71467 9.33829 7.92278 8.6338 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 8.23001 7.4251 6.71467 5.86436 4.56037 7.63159 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.32033 11.5849 7.21809 12.2228 6.99469 7.00234 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 8.32033 5.10938 5.69055 12.2228 6.99469 7.30652 numMergedOcc 0
5 mol 69 unq 2 iso 0 dist 9.16791 9.90874 5.06756 9.38571 7.3232 9.23947 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 6.88956 12.2608 8.1375 11.187 6.4251 8.75165 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 6.1274 5.10468 5.16143 10.3417 4.41993 9.25488 numMergedOcc 0
8 mol 155 unq 1 iso 0 dist 6.1274 5.10468 5.16143 11.1444 5.55092 8.02356 numMergedOcc 0
9 mol 165 unq 0 iso 0 dist 7.22838 9.87383 9.8446 5.81507 5.54803 9.63241 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 9.35708 10.7753 5.31333 7.74764 3.82682 6.36789 numMergedOcc 0
11 mol 217 unq 0 iso 0 dist 7.70005 9.47932 8.80103 10.3827 3.6199 7.81825 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 8.33143 11.8099 6.22332 10.99 4.37243 6.97662 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 8.64849 8.63134 9.5942 8.90583 4.1635 9.03261 numMergedOcc 0
14 mol 226 unq 1 iso 0 dist 8.64849 8.63134 9.5942 14.3472 9.6805 7.67573 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 7.4491 5.3238 8.93135 8.86909 4.91848 7.12027 numMergedOcc 0
16 mol 271 unq 0 iso 0 dist 7.34621 4.7953 7.29764 6.56531 5.25426 6.96986 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 4.98604 4.91435 7.47179 7.51034 10.1749 9.38187 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 4.98604 4.91435 7.47179 7.51034 10.1749 9.38187 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 4.98604 4.91435 7.47179 7.51034 10.1749 9.38187 numMergedOcc 0
