0 mol 19 unq 0 iso 0 dist 6.92532 7.75618 13.9675 7.67038 10.1882 8.40416 8.7083 14.6955 8.54034 10.4416 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.60423 9.41441 11.9395 11.4989 14.156 6.73939 9.88364 13.9632 9.85784 15.4313 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.60423 9.41441 11.9395 11.4989 14.156 6.73939 9.78753 15.2234 9.87996 14.1829 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.72502 8.60554 6.99746 14.6259 11.2485 8.4051 14.8647 13.0098 6.61696 10.1698 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.72502 8.60554 6.99746 14.6259 11.2485 8.4051 5.11636 8.24948 5.80953 13.6174 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 6.72502 8.60554 6.99746 10.0952 10.7114 7.29868 14.8647 13.0098 6.61696 8.91183 numMergedOcc 0
6 mol 24 unq 5 iso 0 dist 6.72502 8.60554 6.99746 10.0952 10.7114 7.29868 5.11636 8.24948 5.80953 5.69214 numMergedOcc 0
7 mol 24 unq 6 iso 0 dist 6.72502 9.44691 7.05541 14.6259 11.2485 8.75662 14.4081 13.5399 9.586 5.50396 numMergedOcc 0
8 mol 24 unq 7 iso 0 dist 4.93188 6.73939 10.0715 11.4989 13.0257 9.41441 15.4313 18.97 9.85784 9.88364 numMergedOcc 0
9 mol 24 unq 8 iso 0 dist 4.93188 6.73939 10.0715 11.4989 13.0257 9.41441 14.1829 18.1962 9.87996 9.78753 numMergedOcc 0
10 mol 25 unq 0 iso 0 dist 6.90155 6.16347 11.0508 10.9391 17.3821 7.45383 5.63212 12.3361 5.20109 6.47509 numMergedOcc 0
11 mol 25 unq 1 iso 0 dist 6.6492 7.45383 11.7817 10.9391 16.357 6.16347 6.47509 12.8378 5.20109 5.63212 numMergedOcc 0
12 mol 26 unq 0 iso 0 dist 8.6385 7.36856 5.30297 7.96502 10.4035 6.46104 7.73394 6.73167 6.07276 5.56139 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 6.76699 6.16242 9.34112 7.81217 11.1595 5.87634 13.0405 11.9059 8.83732 13.7612 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 7.86572 9.97343 5.38571 11.4307 10.271 9.70413 13.4066 6.77921 6.65731 8.54432 numMergedOcc 0
15 mol 170 unq 0 iso 0 dist 8.15099 6.35982 7.29587 6.52462 9.05166 9.10511 4.78249 5.13268 6.47164 4.12764 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 7.71426 5.93786 6.29877 4.91149 11.3367 6.64834 9.35703 11.1022 9.34834 8.99935 numMergedOcc 0
17 mol 171 unq 1 iso 0 dist 7.71426 5.93786 6.29877 4.91149 11.3367 6.64834 9.14311 10.6118 5.74846 7.15048 numMergedOcc 0
18 mol 171 unq 2 iso 0 dist 7.71426 5.93786 6.29877 7.31409 5.10618 8.24693 9.35703 11.1022 9.34834 14.4375 numMergedOcc 0
19 mol 171 unq 3 iso 0 dist 7.71426 5.93786 6.29877 7.31409 5.10618 8.24693 9.14311 10.6118 5.74846 13.6262 numMergedOcc 0
20 mol 171 unq 4 iso 0 dist 7.71426 5.93786 6.29877 8.07119 11.661 7.36698 9.35703 11.1022 9.34834 4.66982 numMergedOcc 0
21 mol 171 unq 5 iso 0 dist 7.71426 5.93786 6.29877 8.07119 11.661 7.36698 9.14311 10.6118 5.74846 3.65288 numMergedOcc 0
22 mol 171 unq 6 iso 0 dist 5.10618 8.24693 6.29877 11.6409 11.3367 6.64834 14.4375 11.1022 9.34834 8.99935 numMergedOcc 0
23 mol 171 unq 7 iso 0 dist 5.10618 8.24693 6.29877 11.6409 11.3367 6.64834 13.6262 10.6118 5.74846 7.15048 numMergedOcc 0
24 mol 171 unq 8 iso 0 dist 5.10618 8.24693 6.29877 7.31409 7.71426 5.93786 14.4375 11.1022 9.34834 9.35703 numMergedOcc 0
25 mol 171 unq 9 iso 0 dist 5.10618 8.24693 6.29877 7.31409 7.71426 5.93786 13.6262 10.6118 5.74846 9.14311 numMergedOcc 0
26 mol 171 unq 10 iso 0 dist 5.10618 8.24693 6.29877 14.1033 11.661 7.36698 14.4375 11.1022 9.34834 4.66982 numMergedOcc 0
27 mol 171 unq 11 iso 0 dist 5.10618 8.24693 6.29877 14.1033 11.661 7.36698 13.6262 10.6118 5.74846 3.65288 numMergedOcc 0
28 mol 186 unq 0 iso 0 dist 6.72641 7.76163 6.71237 14.5862 14.713 8.73217 14.106 10.5765 9.99396 10.8286 numMergedOcc 0
29 mol 186 unq 1 iso 0 dist 7.20574 8.73217 11.8992 14.5862 19.2622 7.76163 10.8286 14.6369 9.99396 14.106 numMergedOcc 0
30 mol 195 unq 0 iso 0 dist 6.60567 7.36683 6.0634 10.7531 7.62942 9.26504 5.41635 6.34234 6.22742 6.04871 numMergedOcc 0
31 mol 195 unq 1 iso 0 dist 7.62942 9.26504 6.0634 10.7531 6.60567 7.36683 6.04871 6.34234 6.22742 5.41635 numMergedOcc 0
32 mol 227 unq 0 iso 0 dist 8.03442 7.43071 12.8075 4.39704 12.2278 6.02296 5.0317 9.43618 9.18728 5.83175 numMergedOcc 0
33 mol 235 unq 0 iso 0 dist 6.39158 6.36341 7.85398 8.31875 11.0084 6.21292 13.089 11.0265 7.39085 10.5354 numMergedOcc 0
34 mol 235 unq 1 iso 0 dist 6.39158 6.36341 7.85398 10.5547 11.2916 9.21736 13.089 11.0265 7.39085 11.3865 numMergedOcc 0
