0 mol 5 unq 0 iso 0 dist 8.70824 5.2392 11.3755 3.67097 6.86923 7.50453 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.93404 5.2392 5.90479 3.67097 4.60775 7.50453 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 6.70655 5.2392 4.59167 3.67097 8.64744 7.50453 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 6.67455 9.90986 4.80254 3.30063 6.70325 8.97754 numMergedOcc 0
4 mol 41 unq 0 iso 0 dist 6.51139 8.0072 9.28138 3.84207 7.16598 11.1115 numMergedOcc 0
5 mol 41 unq 1 iso 0 dist 6.51139 8.0072 9.28138 5.6133 7.42476 13.2412 numMergedOcc 0
6 mol 41 unq 2 iso 0 dist 6.91278 8.0072 4.98483 3.84207 9.14632 11.1115 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 5.02642 7.57749 3.66253 9.83606 7.44805 5.4713 numMergedOcc 0
8 mol 48 unq 0 iso 0 dist 9.14072 5.41774 4.55422 12.884 9.40291 11.1397 numMergedOcc 0
9 mol 48 unq 1 iso 0 dist 9.14072 5.41774 4.55422 14.5015 7.94814 11.4329 numMergedOcc 0
10 mol 48 unq 2 iso 0 dist 9.14072 5.41774 4.55422 16.2483 9.55632 13.4279 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 7.41861 6.63973 6.1999 9.68005 9.50939 5.45099 numMergedOcc 0
12 mol 81 unq 0 iso 0 dist 9.80754 5.73799 11.4429 5.82911 8.57764 10.9472 numMergedOcc 0
13 mol 81 unq 1 iso 0 dist 9.80754 8.38883 4.54161 5.82911 8.57764 8.96045 numMergedOcc 0
14 mol 154 unq 0 iso 0 dist 8.65008 5.06116 7.59527 11.9194 8.76245 9.92057 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 6.09291 6.00783 7.58935 4.24401 6.27378 8.6961 numMergedOcc 0
16 mol 169 unq 1 iso 0 dist 9.90583 8.54444 6.49048 9.35916 6.27378 10.9391 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 9.78743 7.93715 13.2141 16.7863 7.97601 18.4261 numMergedOcc 0
18 mol 193 unq 0 iso 0 dist 6.66555 7.85801 6.90307 11.9413 9.00084 6.94187 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 5.05912 6.41148 9.99561 9.4797 9.21286 13.7245 numMergedOcc 0
20 mol 205 unq 1 iso 0 dist 6.60429 5.06713 9.99561 13.314 9.21286 13.7245 numMergedOcc 0
21 mol 205 unq 2 iso 0 dist 6.60429 8.69512 15.2328 13.314 9.21286 21.2679 numMergedOcc 0
22 mol 230 unq 0 iso 0 dist 5.19913 8.98005 5.84974 6.2863 9.62914 13.6174 numMergedOcc 0
23 mol 230 unq 1 iso 0 dist 5.19913 8.98005 5.84974 12.1033 9.73038 14.987 numMergedOcc 0
24 mol 232 unq 0 iso 0 dist 9.84479 9.85909 14.8057 6.5573 9.36462 16.1398 numMergedOcc 0
25 mol 232 unq 1 iso 0 dist 9.82645 9.85909 15.8965 5.28999 5.86945 13.6277 numMergedOcc 0
26 mol 233 unq 0 iso 0 dist 7.20629 8.84037 3.80398 5.33407 9.8976 12.828 numMergedOcc 0
27 mol 233 unq 1 iso 0 dist 7.20629 8.84037 3.80398 9.06901 7.97911 11.7251 numMergedOcc 0
28 mol 233 unq 2 iso 0 dist 9.44671 5.76164 7.87864 10.6613 9.8976 13.1938 numMergedOcc 0
29 mol 233 unq 3 iso 0 dist 9.44671 5.76164 7.87864 4.45501 7.97911 8.4338 numMergedOcc 0
30 mol 233 unq 4 iso 0 dist 7.21531 5.76164 4.74962 7.70097 8.70416 11.0799 numMergedOcc 0
31 mol 233 unq 5 iso 0 dist 7.21531 5.76164 4.74962 10.2345 8.18379 11.5002 numMergedOcc 0
32 mol 239 unq 0 iso 0 dist 4.53228 7.96523 7.26668 6.29809 5.4687 12.4558 numMergedOcc 0
