0 mol 61 unq 0 iso 0 dist 5.97418 5.39827 9.89377 11.1921 14.7353 9.25641 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 8.00814 7.38868 9.7068 5.57159 7.45675 7.26024 numMergedOcc 0
2 mol 68 unq 1 iso 0 dist 8.00814 9.04129 5.9436 5.57159 7.45675 6.36086 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 9.25371 9.51367 6.08127 8.71534 11.7103 7.02927 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 8.58344 9.10479 7.29711 8.43108 13.8593 9.23858 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 5.68879 9.10479 4.96177 8.43108 10.2589 9.23858 numMergedOcc 0
6 mol 124 unq 0 iso 0 dist 6.31232 7.55095 5.34732 6.27128 7.23052 6.96281 numMergedOcc 0
7 mol 124 unq 1 iso 0 dist 6.79597 9.13301 8.85132 5.07165 10.0106 6.96281 numMergedOcc 0
8 mol 124 unq 2 iso 0 dist 7.17224 7.55095 8.85132 6.27128 10.0106 6.96281 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 8.95717 8.74658 10.0563 6.82985 15.0724 9.90168 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 8.29174 9.62783 5.2832 4.76513 8.11202 6.6554 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 6.6514 7.93807 7.33075 5.89138 11.9706 9.67741 numMergedOcc 0
12 mol 227 unq 0 iso 0 dist 9.09371 5.87056 7.15779 6.78651 12.1015 7.43071 numMergedOcc 0
13 mol 227 unq 1 iso 0 dist 9.09371 5.87056 7.15779 6.02375 12.5006 6.02296 numMergedOcc 0
14 mol 227 unq 2 iso 0 dist 9.09371 9.84311 13.3228 6.78651 12.1015 5.41321 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 5.00402 7.37358 6.69582 5.65983 9.39953 7.23721 numMergedOcc 0
16 mol 284 unq 0 iso 0 dist 5.62295 5.61727 6.50962 10.5879 7.34344 6.78191 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 4.66252 9.52718 13.0167 12.9284 17.245 8.91712 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 4.66252 9.52718 13.0167 6.56751 10.8114 9.65934 numMergedOcc 0
19 mol 287 unq 2 iso 0 dist 9.11602 8.82948 15.3271 6.27066 13.6466 6.89451 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 4.66252 9.52718 13.0167 12.9284 17.245 8.91712 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 4.66252 9.52718 13.0167 6.56751 10.8114 9.65934 numMergedOcc 0
22 mol 288 unq 2 iso 0 dist 9.11602 8.82948 15.3271 6.27066 13.6466 6.89451 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 4.66252 9.52718 13.0167 12.9284 17.245 8.91712 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 4.66252 9.52718 13.0167 6.56751 10.8114 9.65934 numMergedOcc 0
25 mol 289 unq 2 iso 0 dist 9.11602 8.82948 15.3271 6.27066 13.6466 6.89451 numMergedOcc 0
