0 mol 4 unq 0 iso 0 dist 6.05231 5.04676 8.12032 7.00063 9.61247 11.0362 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 7.6082 9.43074 5.07365 13.5196 8.89682 4.37718 numMergedOcc 0
2 mol 32 unq 1 iso 0 dist 7.65602 5.80429 5.07365 4.4478 7.12013 4.88331 numMergedOcc 0
3 mol 32 unq 2 iso 0 dist 9.24687 4.77113 5.07365 4.38241 8.89682 4.37718 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 8.34361 12.1383 4.54428 4.94741 6.10175 8.97716 numMergedOcc 0
5 mol 74 unq 0 iso 0 dist 9.33277 5.19847 5.53993 7.81335 9.50176 9.79292 numMergedOcc 0
6 mol 74 unq 1 iso 0 dist 9.33277 5.19847 5.53993 10.8158 7.56791 10.2416 numMergedOcc 0
7 mol 74 unq 2 iso 0 dist 9.33277 8.58959 8.90166 7.81335 9.50176 5.40973 numMergedOcc 0
8 mol 74 unq 3 iso 0 dist 9.33277 8.58959 8.90166 10.8158 7.56791 4.79362 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 8.04448 8.19607 7.80347 10.9027 3.59451 7.62019 numMergedOcc 0
10 mol 110 unq 0 iso 0 dist 9.71431 10.0455 8.05821 6.72551 8.97683 10.58 numMergedOcc 0
11 mol 110 unq 1 iso 0 dist 9.50277 11.9316 8.05821 9.33806 8.97683 10.58 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 8.85708 8.6257 9.14994 8.3896 5.24519 10.7285 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 7.46875 10.4143 9.12773 6.68239 5.50364 7.31861 numMergedOcc 0
14 mol 131 unq 1 iso 0 dist 7.46875 10.4143 9.12773 7.74794 8.7301 4.55152 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 8.52322 13.4102 9.43841 9.45075 8.40343 4.98693 numMergedOcc 0
16 mol 207 unq 0 iso 0 dist 7.98453 10.2747 8.06401 6.26853 4.55528 4.85991 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 7.43427 5.52817 7.71876 6.86057 5.98076 4.8053 numMergedOcc 0
18 mol 218 unq 1 iso 0 dist 7.50841 11.414 7.71876 12.1138 5.98076 4.8053 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 9.87224 9.61496 9.01934 7.04644 4.21935 5.39741 numMergedOcc 0
