0 mol 24 unq 0 iso 0 dist 8.20058 8.45916 4.79736 16.6906 8.86116 12.3058 17.2959 10.0952 13.0134 6.86014 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 9.22151 9.95169 5.18617 4.96681 7.57578 9.48085 6.22122 4.33106 5.68041 7.17969 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 6.22122 9.95169 5.68041 4.96681 7.17969 9.48085 9.22151 4.33106 5.18617 7.57578 numMergedOcc 0
3 mol 52 unq 0 iso 0 dist 7.70026 8.01537 6.68648 13.9113 7.34143 10.3447 16.3413 9.162 14.292 9.80098 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 6.68311 9.26417 4.03844 15.0607 9.96708 12.111 10.1663 8.24309 11.5881 9.78528 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 6.7212 8.16985 7.47371 11.6369 9.96708 7.12321 12.3223 10.7394 4.27726 8.8178 numMergedOcc 0
6 mol 72 unq 2 iso 0 dist 6.7212 7.81344 9.67587 11.6369 9.96708 9.35457 12.3223 10.7394 5.93202 8.8178 numMergedOcc 0
7 mol 72 unq 3 iso 0 dist 6.7212 5.49421 7.07356 11.6369 9.96708 12.1131 12.3223 10.7394 8.7566 8.8178 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 8.96916 5.30117 6.30222 5.92158 6.45675 5.35782 5.70279 5.33144 5.47563 7.47343 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 8.96916 5.30117 6.30222 5.92158 6.45675 5.35782 9.71692 9.71151 5.03232 8.86688 numMergedOcc 0
10 mol 100 unq 2 iso 0 dist 5.70279 5.30117 5.47563 5.92158 7.47343 5.35782 8.96916 5.33144 6.30222 6.45675 numMergedOcc 0
11 mol 100 unq 3 iso 0 dist 5.70279 5.30117 5.47563 5.92158 7.47343 5.35782 9.71692 10.1407 5.03232 8.86688 numMergedOcc 0
12 mol 100 unq 4 iso 0 dist 5.70279 5.30117 5.47563 5.85449 6.65086 9.94341 11.3277 5.88134 10.8282 9.60661 numMergedOcc 0
13 mol 100 unq 5 iso 0 dist 5.70279 5.30117 5.47563 7.68675 6.56369 9.82522 11.3277 5.88134 10.8282 9.35224 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 8.81172 8.54233 6.57678 5.34484 9.84395 6.10127 11.6152 13.1058 10.5783 7.90328 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 9.79004 4.79003 6.9945 10.0277 7.24514 10.4642 14.9707 6.761 11.8451 9.91388 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 9.79004 4.79003 6.9945 10.0277 7.24514 10.4642 16.8376 7.6656 14.6139 9.52634 numMergedOcc 0
17 mol 133 unq 2 iso 0 dist 9.79004 4.79003 6.9945 7.33132 8.22656 7.22643 8.43069 5.61668 4.19723 6.82262 numMergedOcc 0
18 mol 133 unq 3 iso 0 dist 8.43069 4.79003 4.19723 7.33132 6.82262 7.22643 9.79004 5.61668 6.9945 8.22656 numMergedOcc 0
19 mol 142 unq 0 iso 0 dist 7.15087 5.90339 4.67662 8.68855 9.2313 7.81207 10.5719 5.50998 5.81599 7.73169 numMergedOcc 0
20 mol 142 unq 1 iso 0 dist 7.15087 5.90339 4.67662 8.68855 9.2313 7.81207 15.3413 11.1395 11.1 8.96657 numMergedOcc 0
21 mol 142 unq 2 iso 0 dist 7.15087 5.90339 4.67662 5.50176 5.31024 6.14151 10.5719 5.50998 5.81599 7.26382 numMergedOcc 0
22 mol 155 unq 0 iso 0 dist 5.68636 8.14405 4.91785 7.92939 6.43582 8.97626 12.7322 7.66392 9.16779 7.46303 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 9.73411 5.31916 7.05804 9.81806 6.57273 8.79428 10.1632 5.0744 5.76843 6.60589 numMergedOcc 0
24 mol 224 unq 1 iso 0 dist 9.73411 5.31916 7.05804 5.99647 5.78342 6.8692 10.1632 5.0744 5.76843 9.16166 numMergedOcc 0
25 mol 224 unq 2 iso 0 dist 9.73411 5.31916 7.05804 5.99647 5.78342 6.8692 7.75485 5.60236 4.54188 5.81334 numMergedOcc 0
26 mol 224 unq 3 iso 0 dist 7.75485 5.31916 4.54188 5.99647 5.81334 6.8692 9.73411 5.60236 7.05804 5.78342 numMergedOcc 0
27 mol 224 unq 4 iso 0 dist 7.75485 5.31916 4.54188 5.99647 5.81334 6.8692 10.1632 6.91102 5.76843 9.16166 numMergedOcc 0
28 mol 229 unq 0 iso 0 dist 8.8557 8.3932 4.17276 5.65373 8.22528 10.3243 5.00457 5.57838 4.92403 7.03423 numMergedOcc 0
29 mol 229 unq 1 iso 0 dist 5.00457 8.3932 4.92403 5.65373 7.03423 10.3243 8.8557 5.57838 4.17276 8.22528 numMergedOcc 0
30 mol 231 unq 0 iso 0 dist 8.91036 9.37406 10.7703 10.613 7.37839 12.8638 12.2364 4.06055 14.7311 8.40182 numMergedOcc 0
31 mol 231 unq 1 iso 0 dist 8.91036 8.98908 13.4098 10.613 7.37839 18.1166 12.2364 4.06055 16.8891 8.40182 numMergedOcc 0
32 mol 238 unq 0 iso 0 dist 4.87108 5.41453 6.82305 7.45873 6.22714 10.1172 7.64276 5.34096 5.71717 7.31233 numMergedOcc 0
33 mol 238 unq 1 iso 0 dist 7.64276 5.41453 5.71717 7.45873 7.31233 10.1172 4.87108 5.34096 6.82305 6.22714 numMergedOcc 0
34 mol 259 unq 0 iso 0 dist 5.75874 6.95658 6.73882 5.20592 8.53687 9.07743 10.9903 10.582 8.8603 8.13497 numMergedOcc 0
35 mol 276 unq 0 iso 0 dist 8.79189 8.51449 8.26321 6.33662 6.87396 8.6759 13.9936 6.88557 9.39944 9.8993 numMergedOcc 0
