0 mol 28 unq 0 iso 0 dist 6.87842 8.94643 11.4558 6.23081 12.7132 8.95154 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.21247 6.57978 5.14161 5.39546 6.6263 7.39848 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.8645 8.52681 4.88527 12.9129 13.0948 8.89047 numMergedOcc 0
3 mol 157 unq 0 iso 0 dist 6.07906 9.46735 11.4303 6.91388 12.5116 8.10592 numMergedOcc 0
4 mol 157 unq 1 iso 0 dist 8.72717 9.46735 11.4251 6.91388 13.9545 8.10592 numMergedOcc 0
5 mol 168 unq 0 iso 0 dist 8.18217 5.80055 13.0096 10.9775 19.0785 8.92592 numMergedOcc 0
6 mol 168 unq 1 iso 0 dist 8.18217 7.44481 14.104 10.9775 19.0785 9.57452 numMergedOcc 0
7 mol 168 unq 2 iso 0 dist 5.51167 5.80055 3.5168 10.9775 6.02086 8.92592 numMergedOcc 0
8 mol 168 unq 3 iso 0 dist 5.51167 7.44481 5.43054 10.9775 6.02086 9.57452 numMergedOcc 0
9 mol 198 unq 0 iso 0 dist 9.40433 7.95437 3.70259 9.33462 9.31526 9.7657 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 9.79826 9.21286 15.4119 13.5618 19.9304 7.13783 numMergedOcc 0
11 mol 218 unq 0 iso 0 dist 9.65132 8.96442 13.5381 4.79566 7.33709 7.84952 numMergedOcc 0
12 mol 218 unq 1 iso 0 dist 9.70462 8.96442 5.42052 4.79566 9.24601 7.84952 numMergedOcc 0
13 mol 251 unq 0 iso 0 dist 9.65275 7.90148 3.45567 10.2078 6.50357 8.45764 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 8.9221 5.36518 5.95721 11.9164 14.7378 9.29666 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 9.51145 9.11585 5.95721 17.05 14.7378 9.29666 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 6.42951 9.07744 10.5214 10.2486 13.3371 9.54359 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 6.42951 9.07744 10.5214 7.94155 12.1398 5.69112 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 7.82167 6.37248 5.33188 4.81126 9.5785 5.41432 numMergedOcc 0
19 mol 292 unq 1 iso 0 dist 9.01438 6.37248 8.5186 4.81126 9.76319 5.41432 numMergedOcc 0
