0 mol 0 unq 0 iso 0 dist 8.24206 9.5614 13.3337 9.56842 7.30381 11.2263 13.7029 10.169 10.4498 8.34244 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 5.9021 8.17618 7.58748 7.81704 4.49007 11.7116 10.5896 4.98378 10.9481 4.76018 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 6.60356 9.57498 14.3495 10.0156 9.95103 15.8683 12.0659 7.59628 19.2384 7.09065 numMergedOcc 0
3 mol 167 unq 0 iso 0 dist 9.82329 8.58946 13.1346 7.33075 9.69399 13.7242 9.72291 6.28495 11.206 7.80054 numMergedOcc 0
4 mol 175 unq 0 iso 0 dist 6.21546 6.73365 5.50014 10.3139 9.27911 14.1487 13.7519 12.677 17.4332 9.19117 numMergedOcc 0
5 mol 175 unq 1 iso 0 dist 6.21546 6.73365 5.50014 10.3139 9.27911 14.1487 7.77669 5.2437 10.3111 6.26365 numMergedOcc 0
6 mol 175 unq 2 iso 0 dist 6.21546 6.73365 5.50014 7.04147 8.57607 12.1542 7.77669 5.2437 10.3111 7.04177 numMergedOcc 0
7 mol 175 unq 3 iso 0 dist 6.21546 9.45659 7.39186 10.3139 9.27911 16.2084 13.7519 12.677 16.5914 9.19117 numMergedOcc 0
8 mol 175 unq 4 iso 0 dist 6.21546 9.45659 7.39186 10.3139 9.27911 16.2084 7.77669 5.2437 10.6973 6.26365 numMergedOcc 0
9 mol 175 unq 5 iso 0 dist 6.21546 9.45659 7.39186 7.04147 8.57607 14.966 7.77669 5.2437 10.6973 7.04177 numMergedOcc 0
10 mol 175 unq 6 iso 0 dist 6.21546 9.44856 7.05768 10.3139 9.27911 12.5221 13.7519 12.677 10.1366 9.19117 numMergedOcc 0
11 mol 175 unq 7 iso 0 dist 6.21546 9.44856 7.05768 10.3139 9.27911 12.5221 7.77669 5.2437 6.27043 6.26365 numMergedOcc 0
12 mol 175 unq 8 iso 0 dist 6.21546 9.44856 7.05768 7.04147 8.57607 12.4656 7.77669 5.2437 6.27043 7.04177 numMergedOcc 0
13 mol 250 unq 0 iso 0 dist 8.18086 8.60184 8.69877 8.5106 5.99119 13.504 12.8078 5.85862 14.3259 5.97993 numMergedOcc 0
14 mol 250 unq 1 iso 0 dist 8.18086 8.60184 8.69877 8.5106 5.99119 13.504 11.7415 6.88928 13.7726 6.44252 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 7.39099 9.69025 7.98231 15.1733 15.1483 11.6195 8.71497 numMergedOcc 0
16 mol 271 unq 0 iso 0 dist 8.07242 8.32351 5.6441 6.38496 5.70063 8.98576 9.35549 6.39972 6.78222 5.81266 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 8.78203 6.47376 5.86731 14.4524 8.16582 13.337 10.0666 7.28266 7.69081 9.24367 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 8.04003 9.22306 5.64519 7.04567 8.9316 8.91712 9.11967 5.89971 4.62998 5.59555 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 8.04003 9.22306 5.64519 7.04567 8.9316 8.91712 9.11967 5.89971 4.62998 5.59555 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 8.04003 9.22306 5.64519 7.04567 8.9316 8.91712 9.11967 5.89971 4.62998 5.59555 numMergedOcc 0
