0 mol 91 unq 0 iso 0 dist 9.83906 5.51406 11.5684 10.2967 19.1264 9.30539 8.88997 18.6446 9.97813 4.73184 numMergedOcc 0
1 mol 148 unq 0 iso 0 dist 6.60739 9.80819 12.193 9.27313 14.5372 6.22055 13.1327 17.2323 5.75959 4.73245 numMergedOcc 0
2 mol 148 unq 1 iso 0 dist 6.60739 9.80819 12.193 12.8573 17.3468 8.18085 13.1327 17.2323 5.75959 5.38701 numMergedOcc 0
3 mol 148 unq 2 iso 0 dist 9.22427 9.80819 14.6053 9.27313 16.0211 6.22055 13.1327 18.6273 5.75959 4.73245 numMergedOcc 0
4 mol 148 unq 3 iso 0 dist 9.22427 9.80819 14.6053 12.8573 16.4612 8.18085 13.1327 18.6273 5.75959 5.38701 numMergedOcc 0
5 mol 148 unq 4 iso 0 dist 5.55129 9.80819 11.2269 9.27313 12.1607 6.22055 13.1327 15.3754 5.75959 4.73245 numMergedOcc 0
6 mol 148 unq 5 iso 0 dist 5.55129 9.80819 11.2269 12.8573 16.7687 8.18085 13.1327 15.3754 5.75959 5.38701 numMergedOcc 0
7 mol 150 unq 0 iso 0 dist 6.71763 9.81665 12.1772 9.25213 14.5362 6.14675 13.0356 17.0465 5.4798 4.73768 numMergedOcc 0
8 mol 150 unq 1 iso 0 dist 6.71763 9.81665 12.1772 12.8265 17.2596 7.94889 13.0356 17.0465 5.4798 5.46333 numMergedOcc 0
9 mol 150 unq 2 iso 0 dist 9.32504 9.81665 14.5231 9.25213 15.9858 6.14675 13.0356 18.5065 5.4798 4.73768 numMergedOcc 0
10 mol 150 unq 3 iso 0 dist 9.32504 9.81665 14.5231 12.8265 16.3796 7.94889 13.0356 18.5065 5.4798 5.46333 numMergedOcc 0
11 mol 150 unq 4 iso 0 dist 5.53778 9.81665 11.1674 9.25213 12.148 6.14675 13.0356 15.1483 5.4798 4.73768 numMergedOcc 0
12 mol 150 unq 5 iso 0 dist 5.53778 9.81665 11.1674 12.8265 16.6473 7.94889 13.0356 15.1483 5.4798 5.46333 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 6.13872 5.66363 9.21613 9.47799 11.2315 8.90963 3.55808 6.19329 9.20617 11.618 numMergedOcc 0
14 mol 188 unq 0 iso 0 dist 8.48582 9.37017 8.98299 4.04545 9.24118 8.10214 11.2153 15.184 8.4784 8.02684 numMergedOcc 0
15 mol 188 unq 1 iso 0 dist 9.94804 9.37017 11.054 4.04545 12.7721 8.10214 11.2153 17.8692 8.4784 8.02684 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 6.09754 5.86419 5.42117 4.78067 8.43584 4.8668 3.83801 5.32465 7.75318 7.35363 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 9.4886 8.63176 8.01004 8.27707 6.09782 9.63959 10.3385 9.30975 9.36974 4.83605 numMergedOcc 0
18 mol 258 unq 1 iso 0 dist 9.4886 8.63176 8.01004 13.5559 15.1009 9.96262 10.3385 9.30975 9.36974 8.21389 numMergedOcc 0
19 mol 258 unq 2 iso 0 dist 9.4886 8.63176 8.01004 6.48867 12.9664 7.21311 10.3385 9.30975 9.36974 11.9728 numMergedOcc 0
20 mol 273 unq 0 iso 0 dist 8.78928 6.38341 5.06747 5.75973 8.90885 8.83865 10.2963 12.6851 9.81919 9.32873 numMergedOcc 0
21 mol 273 unq 1 iso 0 dist 8.78928 6.38341 5.06747 9.40198 9.96963 9.18157 10.2963 12.6851 9.81919 5.04315 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 8.34389 8.42076 13.6869 8.60619 10.9612 6.89451 9.03098 13.4969 7.99204 4.21609 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 8.34389 8.42076 13.6869 8.60619 10.9612 6.89451 9.03098 13.4969 7.99204 4.21609 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 8.34389 8.42076 13.6869 8.60619 10.9612 6.89451 9.03098 13.4969 7.99204 4.21609 numMergedOcc 0
