0 mol 17 unq 0 iso 0 dist 6.80314 8.6745 11.6437 7.83348 5.16502 15.3804 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 6.80314 8.6745 11.6437 4.2802 8.26398 12.6285 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 6.42242 6.68961 3.90503 10.3657 7.84895 11.6965 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 6.42242 6.68961 3.90503 10.4457 5.8541 9.6867 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 6.42242 6.68961 3.90503 10.1874 5.82264 6.17378 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 6.42242 6.68961 3.90503 5.39197 7.20729 8.97853 numMergedOcc 0
6 mol 48 unq 4 iso 0 dist 6.42242 6.68961 3.90503 4.89976 5.72703 8.53204 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 8.83135 8.52436 10.8586 14.6513 8.04853 16.9584 numMergedOcc 0
8 mol 85 unq 1 iso 0 dist 8.83135 8.52436 10.8586 9.99421 6.46549 9.5101 numMergedOcc 0
9 mol 116 unq 0 iso 0 dist 7.92221 8.33185 7.22598 8.53743 8.58308 13.662 numMergedOcc 0
10 mol 128 unq 0 iso 0 dist 7.61237 5.23695 12.1608 8.12622 7.4442 12.8445 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 7.50264 5.20195 6.06606 11.8519 8.31198 12.2254 numMergedOcc 0
12 mol 158 unq 0 iso 0 dist 7.23059 4.89503 4.09908 6.50596 4.6512 6.77583 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 6.23057 6.50586 5.19196 4.51847 6.81516 7.88986 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 6.23057 6.50586 5.19196 13.1148 9.17562 12.8795 numMergedOcc 0
15 mol 205 unq 2 iso 0 dist 5.63477 6.75579 5.28417 3.50159 5.59832 4.97301 numMergedOcc 0
16 mol 217 unq 0 iso 0 dist 7.63191 8.98494 4.17047 9.311 8.4493 12.2956 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 9.54381 8.62843 14.1115 6.09382 9.32971 14.673 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 9.24164 7.03656 3.80663 11.0658 8.25623 10.2657 numMergedOcc 0
19 mol 279 unq 1 iso 0 dist 9.24164 7.03656 3.80663 5.67885 8.77098 8.62266 numMergedOcc 0
20 mol 279 unq 2 iso 0 dist 9.24164 7.03656 3.80663 13.3369 9.78784 12.6089 numMergedOcc 0
