0 mol 20 unq 0 iso 0 dist 7.33632 8.71628 9.03714 6.98731 11.9031 6.4934 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 7.33632 8.71628 9.03714 12.0498 14.2727 6.93199 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 9.8598 6.18328 4.64762 5.31061 9.37094 8.1114 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 7.09141 7.70428 4.96926 9.32366 12.1167 8.33704 numMergedOcc 0
4 mol 70 unq 1 iso 0 dist 7.09141 7.70428 4.96926 7.61147 11.2717 7.92394 numMergedOcc 0
5 mol 70 unq 2 iso 0 dist 7.68652 8.06918 14.4842 9.17087 12.2091 8.33704 numMergedOcc 0
6 mol 70 unq 3 iso 0 dist 7.68652 8.06918 14.4842 5.33532 7.63663 7.92394 numMergedOcc 0
7 mol 70 unq 4 iso 0 dist 7.68652 7.52623 14.7467 5.33532 7.63663 9.93423 numMergedOcc 0
8 mol 70 unq 5 iso 0 dist 7.68652 5.62294 5.93792 5.33532 7.63663 9.34122 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 6.56224 9.59094 12.1124 11.0811 15.5187 7.92688 numMergedOcc 0
10 mol 209 unq 0 iso 0 dist 7.95916 5.20111 6.18167 5.35615 12.0618 9.52027 numMergedOcc 0
11 mol 218 unq 0 iso 0 dist 9.95318 7.89694 5.22669 7.82717 8.2088 9.50586 numMergedOcc 0
12 mol 218 unq 1 iso 0 dist 9.95318 5.66171 7.85937 12.0404 9.82905 7.17547 numMergedOcc 0
13 mol 218 unq 2 iso 0 dist 9.95318 5.66171 7.85937 7.82717 8.2088 7.13323 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 7.94402 7.54327 10.1743 5.28657 10.1122 6.16063 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 7.35597 9.07397 5.30958 14.2669 11.6421 7.67322 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 7.35597 6.19297 6.2139 11.4969 15.8904 9.90142 numMergedOcc 0
17 mol 238 unq 2 iso 0 dist 7.35597 6.19297 6.2139 6.33281 11.2146 5.9216 numMergedOcc 0
18 mol 267 unq 0 iso 0 dist 7.42127 6.87713 11.1943 11.9598 18.7218 8.76007 numMergedOcc 0
19 mol 267 unq 1 iso 0 dist 6.40976 6.87713 6.07755 11.9598 14.0067 8.76007 numMergedOcc 0
20 mol 267 unq 2 iso 0 dist 9.77803 6.87713 12.843 11.9598 17.8165 8.76007 numMergedOcc 0
21 mol 272 unq 0 iso 0 dist 9.86454 6.27189 8.07198 9.92738 11.8058 7.67853 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 6.89781 8.38395 5.18671 6.45522 11.1412 9.19234 numMergedOcc 0
