0 mol 162 unq 0 iso 0 dist 8.954 9.42819 8.35998 16.1423 9.25835 17.1274 15.2202 6.71523 14.0671 6.45896 numMergedOcc 0
1 mol 167 unq 0 iso 0 dist 9.82329 8.58946 13.1346 7.33075 9.69399 13.7242 11.9706 12.5567 11.4165 9.67741 numMergedOcc 0
2 mol 181 unq 0 iso 0 dist 6.47689 9.63295 5.16386 5.39949 6.66608 6.41453 13.3844 11.067 8.85576 9.39829 numMergedOcc 0
3 mol 219 unq 0 iso 0 dist 4.67452 7.24832 5.48556 6.66401 9.30312 10.3776 8.09769 10.0509 7.02195 7.59632 numMergedOcc 0
4 mol 223 unq 0 iso 0 dist 7.80764 7.34316 11.4951 10.5593 6.64193 16.4299 9.94212 4.67731 12.3422 7.48463 numMergedOcc 0
5 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 7.39099 9.69025 7.98231 11.1532 11.8501 6.96053 7.08526 numMergedOcc 0
6 mol 271 unq 0 iso 0 dist 8.07242 8.32351 5.6441 6.38496 5.70063 8.98576 12.4662 5.0976 7.04094 8.92636 numMergedOcc 0
7 mol 274 unq 0 iso 0 dist 9.07452 6.21831 6.57235 16.1753 8.30714 12.727 15.8932 7.97998 14.4969 7.46394 numMergedOcc 0
8 mol 274 unq 1 iso 0 dist 9.07452 6.21831 6.57235 16.1753 8.30714 12.727 21.1839 12.3018 16.7995 9.45514 numMergedOcc 0
9 mol 274 unq 2 iso 0 dist 9.07452 6.21831 6.57235 16.1753 8.30714 12.727 15.0027 9.61244 9.12834 8.91672 numMergedOcc 0
10 mol 274 unq 3 iso 0 dist 9.07452 6.21831 6.57235 16.1753 8.30714 12.727 14.7203 5.7745 11.3158 7.1729 numMergedOcc 0
11 mol 274 unq 4 iso 0 dist 6.44266 9.79674 9.61244 7.28382 8.30714 8.91672 10.3113 7.97998 14.3919 7.46394 numMergedOcc 0
12 mol 274 unq 5 iso 0 dist 6.44266 9.79674 9.61244 7.28382 8.30714 8.91672 15.4388 12.3018 11.7196 9.45514 numMergedOcc 0
13 mol 274 unq 6 iso 0 dist 6.44266 9.79674 9.61244 7.28382 8.30714 8.91672 10.3376 5.7745 10.0083 7.1729 numMergedOcc 0
14 mol 274 unq 7 iso 0 dist 6.44266 8.3291 6.57235 7.28382 8.30714 12.727 10.3113 7.97998 14.4969 7.46394 numMergedOcc 0
15 mol 274 unq 8 iso 0 dist 6.44266 8.3291 6.57235 7.28382 8.30714 12.727 15.4388 12.3018 16.7995 9.45514 numMergedOcc 0
16 mol 274 unq 9 iso 0 dist 6.44266 8.3291 6.57235 7.28382 8.30714 12.727 9.79674 9.61244 9.12834 8.91672 numMergedOcc 0
17 mol 274 unq 10 iso 0 dist 6.44266 8.3291 6.57235 7.28382 8.30714 12.727 10.3376 5.7745 11.3158 7.1729 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 8.78203 6.47376 5.86731 14.4524 8.16582 13.337 14.865 9.36068 11.9492 7.23721 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 8.04003 9.22306 5.64519 7.04567 8.9316 8.91712 15.7027 12.3119 10.9208 9.65934 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 8.04003 9.22306 5.64519 7.04567 8.9316 8.91712 15.7027 12.3119 10.9208 9.65934 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 8.04003 9.22306 5.64519 7.04567 8.9316 8.91712 15.7027 12.3119 10.9208 9.65934 numMergedOcc 0
