0 mol 8 unq 0 iso 0 dist 8.33604 7.3915 11.705 12.4076 17.5554 6.82379 8.53529 11.4716 5.65816 7.03958 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.87449 7.032 6.93413 5.06358 12.9221 7.9944 8.64915 10.9409 4.58685 6.55811 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.87449 7.032 6.93413 5.06358 12.9221 7.9944 8.17347 8.50857 5.83039 7.36018 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 9.87449 7.032 6.93413 5.06358 12.9221 7.9944 11.3467 12.7224 9.06304 8.48677 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 8.73972 6.36455 6.87842 5.03957 8.23643 6.92532 12.3215 14.4867 13.9675 7.75618 numMergedOcc 0
5 mol 19 unq 1 iso 0 dist 6.00439 7.48847 6.34272 10.8007 7.82528 6.92532 15.4288 11.4087 13.9675 7.75618 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 7.685 5.81959 9.96732 10.6808 16.7035 6.90155 16.0183 20.8582 11.0508 6.16347 numMergedOcc 0
7 mol 25 unq 1 iso 0 dist 7.685 5.81959 9.96732 10.6808 16.7035 6.90155 8.6653 12.9735 6.61233 7.92503 numMergedOcc 0
8 mol 26 unq 0 iso 0 dist 9.16962 5.69955 4.80984 9.78225 10.9838 8.6385 10.177 4.98603 5.30297 7.36856 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 9.20981 7.55384 5.94311 4.98336 5.87358 5.34214 12.2341 6.89298 10.8469 7.80523 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 8.6243 6.92648 6.01893 6.63273 6.91348 9.29384 12.6227 9.93183 10.8127 8.70296 numMergedOcc 0
11 mol 131 unq 1 iso 0 dist 8.6243 6.92648 6.01893 6.63273 6.91348 9.29384 11.586 5.90177 11.2516 9.25558 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 6.93652 6.69515 8.00633 6.21253 11.8898 7.86572 11.0743 13.2993 5.38571 9.97343 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 6.47873 6.26839 6.8278 14.6506 11.9484 8.83356 16.3687 10.7483 12.361 8.29382 numMergedOcc 0
14 mol 194 unq 1 iso 0 dist 6.47873 6.26839 6.8278 14.6506 11.9484 8.83356 12.4952 8.87374 7.50057 6.72379 numMergedOcc 0
15 mol 194 unq 2 iso 0 dist 5.48258 8.83356 7.69247 14.6506 12.1599 6.26839 12.645 11.8663 5.92931 8.65535 numMergedOcc 0
16 mol 194 unq 3 iso 0 dist 6.15769 8.83356 13.9521 14.6506 18.923 6.26839 12.645 18.1378 5.92931 8.65535 numMergedOcc 0
17 mol 194 unq 4 iso 0 dist 8.38695 8.2654 6.8278 8.48054 6.47873 6.26839 13.9101 10.7231 5.92931 8.65535 numMergedOcc 0
18 mol 194 unq 5 iso 0 dist 8.38695 8.2654 6.8278 11.6097 11.9484 8.83356 14.3769 10.7483 12.361 8.29382 numMergedOcc 0
19 mol 194 unq 6 iso 0 dist 8.38695 8.2654 6.8278 11.6097 11.9484 8.83356 13.2138 8.87374 7.50057 6.72379 numMergedOcc 0
20 mol 195 unq 0 iso 0 dist 8.36117 7.62942 9.08602 10.7531 9.36654 6.60567 9.26504 4.4994 6.0634 7.36683 numMergedOcc 0
21 mol 195 unq 1 iso 0 dist 8.36117 7.62942 9.08602 10.7531 9.36654 6.60567 14.0524 13.8148 6.74112 6.95086 numMergedOcc 0
22 mol 195 unq 2 iso 0 dist 6.77578 7.62942 8.18628 10.7531 11.955 6.60567 9.26504 5.99784 6.0634 7.36683 numMergedOcc 0
23 mol 195 unq 3 iso 0 dist 6.77578 7.62942 8.18628 10.7531 11.955 6.60567 14.0524 14.2666 6.74112 6.95086 numMergedOcc 0
24 mol 234 unq 0 iso 0 dist 9.5707 7.5366 16.5499 5.88703 10.3388 8.24186 13.293 18.2483 9.68666 9.81425 numMergedOcc 0
25 mol 234 unq 1 iso 0 dist 7.85175 7.5366 13.0974 5.88703 6.25105 8.24186 13.293 13.0631 9.68666 9.81425 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 9.68513 6.4398 6.48619 5.40359 12.5477 6.66971 10.1217 10.3809 4.77308 7.57812 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 9.68513 6.4398 6.48619 5.40359 12.5477 6.66971 13.492 16.4621 10.2777 8.69104 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 9.68513 6.4398 6.48619 10.1648 9.29858 7.32982 10.1217 10.3809 4.77308 9.24557 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 9.29858 7.32982 6.48619 10.0191 12.5477 6.66971 9.24557 10.3809 4.77308 7.57812 numMergedOcc 0
30 mol 238 unq 4 iso 0 dist 9.29858 7.32982 6.48619 10.0191 12.5477 6.66971 12.9364 16.4621 10.2777 8.69104 numMergedOcc 0
31 mol 238 unq 5 iso 0 dist 9.90142 6.66971 5.8333 10.0191 10.7386 7.32982 7.57812 10.3147 4.77308 9.24557 numMergedOcc 0
32 mol 238 unq 6 iso 0 dist 5.9216 6.4398 5.8333 5.40359 9.90142 6.66971 10.1217 10.3147 4.77308 7.57812 numMergedOcc 0
33 mol 238 unq 7 iso 0 dist 5.9216 6.4398 5.8333 5.40359 9.90142 6.66971 13.492 15.6823 10.2777 8.69104 numMergedOcc 0
34 mol 238 unq 8 iso 0 dist 5.9216 6.4398 5.8333 10.1648 10.7386 7.32982 10.1217 10.3147 4.77308 9.24557 numMergedOcc 0
35 mol 240 unq 0 iso 0 dist 7.03489 8.44909 9.75032 4.28414 6.15305 9.47583 10.5594 9.66581 15.5587 6.68687 numMergedOcc 0
36 mol 259 unq 0 iso 0 dist 6.77938 8.59697 12.1218 9.98105 14.5785 8.55558 10.4552 12.0428 6.31909 7.08526 numMergedOcc 0
37 mol 259 unq 1 iso 0 dist 7.76676 8.59697 9.22203 9.98105 10.4634 8.55558 10.4552 6.47089 6.31909 7.08526 numMergedOcc 0
