0 mol 43 unq 0 iso 0 dist 9.93832 7.05402 7.31982 10.8828 7.24352 4.69849 17.3252 8.41793 11.8517 9.50614 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 9.93832 7.05402 7.31982 10.8828 7.24352 4.69849 6.6263 4.55347 7.15901 8.34145 numMergedOcc 0
2 mol 43 unq 2 iso 0 dist 8.60739 5.48048 7.31982 5.07458 7.24352 4.69849 13.8936 8.41793 11.8517 9.50614 numMergedOcc 0
3 mol 43 unq 3 iso 0 dist 8.60739 5.48048 7.31982 5.07458 7.24352 4.69849 6.75943 4.55347 7.15901 8.34145 numMergedOcc 0
4 mol 43 unq 4 iso 0 dist 8.44903 5.64171 7.31982 4.96926 7.15901 4.55347 6.66407 4.69849 7.24352 8.34145 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 8.63486 12.8132 6.91393 6.15355 5.07125 8.12964 14.0014 12.931 13.9523 9.47401 numMergedOcc 0
6 mol 56 unq 1 iso 0 dist 8.63486 16.7219 8.40038 6.15355 5.07125 11.6453 14.0014 12.931 15.539 9.47401 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 9.81831 11.6865 5.51624 9.34182 5.71763 11.0802 15.9513 7.92049 12.5147 7.23305 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 9.81831 12.2598 7.8674 9.34182 5.71763 5.33894 15.9513 7.92049 6.18348 7.23305 numMergedOcc 0
9 mol 93 unq 2 iso 0 dist 9.12858 7.64463 5.51624 12.0103 5.71763 11.0802 16.9296 7.92049 12.5147 7.23305 numMergedOcc 0
10 mol 93 unq 3 iso 0 dist 9.12858 14.8533 7.8674 12.0103 5.71763 5.33894 16.9296 7.92049 6.18348 7.23305 numMergedOcc 0
11 mol 93 unq 4 iso 0 dist 9.4523 8.29171 5.51624 12.9351 5.71763 11.0802 15.7468 7.92049 12.5147 7.23305 numMergedOcc 0
12 mol 93 unq 5 iso 0 dist 9.4523 12.7936 7.8674 12.9351 5.71763 5.33894 15.7468 7.92049 6.18348 7.23305 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 6.69515 9.76015 8.26172 13.2918 6.77921 10.2834 8.07097 5.25982 9.18511 7.92216 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 7.86572 8.24418 8.26172 13.4066 6.77921 10.2834 11.5913 5.25982 9.18511 7.92216 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.83476 6.87725 8.12349 13.6744 7.04815 9.57029 14.3269 5.40422 12.2866 5.67168 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 9.83476 6.87725 8.12349 15.0914 6.07389 10.8203 15.3662 6.81727 14.6352 8.36129 numMergedOcc 0
17 mol 186 unq 2 iso 0 dist 9.83476 6.87725 8.12349 15.0914 6.07389 10.8203 14.3269 5.40422 12.2866 5.86483 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 8.87609 11.5135 6.53728 3.97158 7.8744 11.6976 12.2719 6.05548 11.3657 9.3502 numMergedOcc 0
19 mol 225 unq 1 iso 0 dist 8.87609 11.5135 6.53728 9.9875 4.98402 11.2847 12.2719 6.05548 11.3657 6.46405 numMergedOcc 0
20 mol 227 unq 0 iso 0 dist 8.38865 10.5813 9.56257 4.1511 5.28771 11.2819 5.23634 7.3164 9.43618 6.09335 numMergedOcc 0
21 mol 227 unq 1 iso 0 dist 5.4694 7.22396 9.56257 4.69247 5.28771 11.2819 6.91318 7.3164 9.43618 6.09335 numMergedOcc 0
22 mol 227 unq 2 iso 0 dist 8.03442 11.0628 9.56257 5.0317 9.43618 7.3164 11.595 14.9695 10.5857 8.85955 numMergedOcc 0
23 mol 227 unq 3 iso 0 dist 8.03442 11.0628 9.56257 5.0317 9.43618 7.3164 9.91384 11.2819 5.28771 6.09335 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 5.52379 14.1055 9.89583 4.48415 6.53286 13.0611 8.63015 8.5378 13.4758 4.66186 numMergedOcc 0
25 mol 251 unq 0 iso 0 dist 8.01198 6.6269 8.53757 4.86046 6.42747 8.08775 12.7504 9.29305 10.5631 9.02417 numMergedOcc 0
26 mol 264 unq 0 iso 0 dist 7.52281 4.48907 5.74568 5.71153 6.02757 5.82131 5.90924 7.36132 7.14086 9.78237 numMergedOcc 0
27 mol 264 unq 1 iso 0 dist 7.52281 4.48907 5.74568 6.87635 8.67231 9.58444 5.90924 7.36132 7.14086 9.95798 numMergedOcc 0
28 mol 264 unq 2 iso 0 dist 6.42588 10.1591 5.74568 6.56539 6.02757 5.82131 9.58916 7.36132 7.14086 9.78237 numMergedOcc 0
29 mol 264 unq 3 iso 0 dist 6.42588 10.1591 5.74568 4.76241 8.67231 9.58444 9.58916 7.36132 7.14086 9.95798 numMergedOcc 0
30 mol 264 unq 4 iso 0 dist 6.04162 6.84156 5.74568 11.4167 7.14086 7.36132 9.19754 5.82131 6.02757 9.78237 numMergedOcc 0
31 mol 264 unq 5 iso 0 dist 6.04162 6.84156 5.74568 11.4167 7.14086 7.36132 15.803 10.0297 11.9664 9.70101 numMergedOcc 0
32 mol 264 unq 6 iso 0 dist 6.04162 6.84156 5.74568 11.4167 7.14086 7.36132 13.8802 9.58444 8.67231 9.95798 numMergedOcc 0
33 mol 264 unq 7 iso 0 dist 6.14323 9.37297 5.74568 13.2035 7.14086 7.36132 8.29262 5.82131 6.02757 9.78237 numMergedOcc 0
34 mol 264 unq 8 iso 0 dist 6.14323 9.37297 5.74568 13.2035 7.14086 7.36132 14.4964 10.0297 11.9664 9.70101 numMergedOcc 0
35 mol 264 unq 9 iso 0 dist 6.14323 9.37297 5.74568 13.2035 7.14086 7.36132 13.4196 9.58444 8.67231 9.95798 numMergedOcc 0
