0 mol 7 unq 0 iso 0 dist 8.41173 6.22892 6.3027 7.15287 13.8674 8.41585 15.5737 13.0255 9.68596 14.7759 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.14952 5.83658 4.92824 10.826 13.7022 9.60499 4.91115 10.4566 6.02702 8.43473 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.0166 6.22805 5.70161 6.96396 12.2471 7.10621 13.6771 10.0459 8.72114 13.8829 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.32945 6.22805 4.57188 6.96396 10.2729 7.10621 13.6771 10.4728 8.72114 13.8829 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 9.90117 6.22805 6.09254 6.96396 7.21217 7.10621 13.6771 12.8055 8.72114 13.8829 numMergedOcc 0
5 mol 41 unq 0 iso 0 dist 8.28673 4.68793 10.9806 5.72331 13.7715 6.19529 8.68242 15.2506 8.51663 8.94326 numMergedOcc 0
6 mol 75 unq 0 iso 0 dist 7.89636 7.118 6.33557 5.06305 10.6919 7.79912 9.08979 13.1154 9.81166 11.4997 numMergedOcc 0
7 mol 75 unq 1 iso 0 dist 9.49608 7.118 9.95193 5.06305 11.1009 7.79912 9.08979 17.1783 9.81166 11.4997 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 8.63522 9.0361 10.2218 7.49575 12.8661 7.36792 13.32 14.4245 8.31932 7.42011 numMergedOcc 0
9 mol 102 unq 1 iso 0 dist 5.43401 9.0361 8.17186 7.49575 9.10229 7.36792 13.32 11.7662 8.31932 7.42011 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.24549 6.85677 5.19198 4.99061 6.49205 6.18601 5.00632 10.0649 6.73586 5.13589 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 8.6609 9.45659 11.0866 5.73338 10.7272 6.57069 14.0022 17.443 9.77896 8.29015 numMergedOcc 0
12 mol 175 unq 1 iso 0 dist 6.21546 9.45659 7.39186 5.73338 8.69888 6.57069 14.0022 15.8107 9.77896 8.29015 numMergedOcc 0
13 mol 175 unq 2 iso 0 dist 6.03184 9.45659 5.77256 5.73338 5.08206 6.57069 14.0022 11.0322 9.77896 8.29015 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 6.47689 9.63295 5.16386 12.5935 11.5992 7.63312 14.1039 10.9743 5.9176 5.63555 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 6.47689 9.63295 5.16386 12.5935 11.5992 7.63312 5.39949 6.66608 6.41453 7.20191 numMergedOcc 0
16 mol 223 unq 0 iso 0 dist 9.29204 9.94212 18.385 11.4946 18.8401 8.77153 10.5593 19.6879 7.48463 11.8654 numMergedOcc 0
17 mol 223 unq 1 iso 0 dist 9.29204 9.94212 18.385 13.1422 22.2602 8.6166 10.5593 19.6879 7.48463 6.05524 numMergedOcc 0
18 mol 223 unq 2 iso 0 dist 9.14789 9.94212 19.0281 11.4946 19.381 8.77153 10.5593 18.5863 7.48463 11.8654 numMergedOcc 0
19 mol 223 unq 3 iso 0 dist 9.14789 9.94212 19.0281 13.1422 21.4312 8.6166 10.5593 18.5863 7.48463 6.05524 numMergedOcc 0
20 mol 223 unq 4 iso 0 dist 7.80764 9.94212 4.67731 11.4946 12.0111 8.77153 10.5593 6.64193 7.48463 11.8654 numMergedOcc 0
21 mol 223 unq 5 iso 0 dist 7.80764 9.94212 4.67731 13.1422 10.6785 8.6166 10.5593 6.64193 7.48463 6.05524 numMergedOcc 0
22 mol 223 unq 6 iso 0 dist 5.75896 9.94212 7.19485 11.4946 9.5211 8.77153 10.5593 11.867 7.48463 11.8654 numMergedOcc 0
23 mol 223 unq 7 iso 0 dist 5.75896 9.94212 7.19485 13.1422 13.3416 8.6166 10.5593 11.867 7.48463 6.05524 numMergedOcc 0
24 mol 224 unq 0 iso 0 dist 6.6537 7.04127 6.46679 11.7724 14.4547 9.40098 13.4507 13.8414 9.51597 4.98993 numMergedOcc 0
25 mol 224 unq 1 iso 0 dist 6.6537 7.04127 6.46679 4.55824 9.75313 6.61986 13.4507 13.8414 9.51597 12.4692 numMergedOcc 0
26 mol 224 unq 2 iso 0 dist 9.08719 7.04127 7.85135 11.7724 13.1222 9.40098 13.4507 15.5459 9.51597 4.98993 numMergedOcc 0
27 mol 224 unq 3 iso 0 dist 9.08719 7.04127 7.85135 4.55824 6.08709 6.61986 13.4507 15.5459 9.51597 12.4692 numMergedOcc 0
28 mol 231 unq 0 iso 0 dist 7.28719 9.98232 5.3251 10.9863 7.79865 7.37839 11.1156 11.2829 7.79066 9.0443 numMergedOcc 0
29 mol 231 unq 1 iso 0 dist 7.28719 9.98232 5.3251 10.2117 6.14348 8.40182 11.1156 11.2829 7.79066 12.1512 numMergedOcc 0
30 mol 232 unq 0 iso 0 dist 5.92175 7.47238 4.90814 10.134 11.2186 8.27212 15.5413 13.5442 9.05071 8.80479 numMergedOcc 0
31 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 10.908 6.77279 8.13497 7.39099 9.69025 7.98231 8.41846 numMergedOcc 0
32 mol 259 unq 1 iso 0 dist 6.76656 6.96379 5.71237 12.7595 9.58006 7.88519 7.39099 9.69025 7.98231 8.81835 numMergedOcc 0
