0 mol 24 unq 0 iso 0 dist 6.72502 8.44664 7.6844 5.11636 8.24948 12.8213 8.60554 6.99746 14.1496 5.80953 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.72502 9.44691 7.05541 5.11636 8.24948 11.7489 8.60554 6.99746 9.62033 5.80953 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 6.61823 8.91313 14.4996 5.31547 6.98037 12.273 9.75237 8.67827 18.0963 6.59716 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 6.61823 8.91313 14.4996 4.3481 6.9223 12.7637 9.75237 8.67827 18.0963 6.87506 numMergedOcc 0
4 mol 92 unq 2 iso 0 dist 6.61823 8.16392 6.90324 5.31547 6.98037 10.9647 9.75237 8.67827 15.0895 6.59716 numMergedOcc 0
5 mol 92 unq 3 iso 0 dist 6.61823 8.16392 6.90324 4.3481 6.9223 11.1106 9.75237 8.67827 15.0895 6.87506 numMergedOcc 0
6 mol 92 unq 4 iso 0 dist 6.49956 8.91313 12.0757 4.3481 7.0561 12.7637 9.75237 13.0818 18.0963 6.87506 numMergedOcc 0
7 mol 92 unq 5 iso 0 dist 6.49956 8.16392 7.64508 4.3481 7.0561 11.1106 9.75237 13.0818 15.0895 6.87506 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.26086 6.65501 11.2092 3.9764 8.75597 4.62494 11.3043 8.02554 10.2754 9.84703 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 9.29384 8.70296 10.8127 12.6005 6.78801 12.7349 14.9021 5.66194 14.4581 7.75314 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 9.29384 9.25558 11.2516 12.6005 6.78801 17.5196 14.9021 5.66194 15.5632 7.75314 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 7.25673 7.78652 6.60479 4.78563 8.612 5.06564 8.91301 7.54337 4.30566 7.5373 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 7.25673 8.91301 7.54337 4.78563 8.612 7.5373 7.78652 6.60479 4.30566 5.06564 numMergedOcc 0
13 mol 159 unq 0 iso 0 dist 7.25742 9.17787 10.3427 4.48323 6.07821 12.5346 8.4858 7.97232 7.73341 9.35202 numMergedOcc 0
14 mol 170 unq 0 iso 0 dist 8.15099 6.35982 7.29587 4.78249 5.13268 6.47164 7.51126 8.73585 6.24983 9.65126 numMergedOcc 0
15 mol 170 unq 1 iso 0 dist 8.15099 7.51126 8.73585 4.78249 5.13268 9.65126 6.35982 7.29587 6.24983 6.47164 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 8.57261 8.10214 5.87427 9.71636 7.79115 11.506 7.14503 5.0782 9.01338 8.66624 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 6.26839 8.65535 5.92931 11.8031 6.72182 11.7017 12.4952 7.50057 9.4131 9.00322 numMergedOcc 0
18 mol 194 unq 1 iso 0 dist 8.83356 8.29382 12.361 10.463 5.53324 15.7666 12.645 5.92931 15.8297 4.19371 numMergedOcc 0
19 mol 194 unq 2 iso 0 dist 8.83356 8.29382 12.361 4.66791 6.72182 11.2491 6.72379 7.50057 6.7294 9.00322 numMergedOcc 0
20 mol 194 unq 3 iso 0 dist 8.83356 6.72379 7.50057 10.463 5.53324 9.64441 12.645 5.92931 9.4131 4.19371 numMergedOcc 0
21 mol 195 unq 0 iso 0 dist 6.60567 7.36683 6.0634 11.9954 7.87972 13.3723 17.8873 11.4252 15.4038 9.24936 numMergedOcc 0
22 mol 195 unq 1 iso 0 dist 6.60567 6.95086 6.74112 5.41635 6.34234 10.8593 7.36683 6.0634 9.90317 6.22742 numMergedOcc 0
23 mol 195 unq 2 iso 0 dist 6.60567 6.95086 6.74112 11.9954 7.87972 11.9372 17.8873 11.4252 15.9146 9.24936 numMergedOcc 0
24 mol 195 unq 3 iso 0 dist 7.62942 9.26504 6.0634 8.04534 7.87972 13.3723 11.9628 11.4252 15.4038 9.24936 numMergedOcc 0
25 mol 212 unq 0 iso 0 dist 6.29767 9.74144 9.75095 3.9436 5.50658 12.0526 8.69988 12.8059 12.5482 9.10288 numMergedOcc 0
26 mol 212 unq 1 iso 0 dist 6.29767 9.74144 9.75095 3.9436 5.50658 12.0526 8.55903 10.7914 15.0034 6.19798 numMergedOcc 0
27 mol 212 unq 2 iso 0 dist 6.29767 9.74144 9.75095 3.9436 5.50658 12.0526 10.6618 10.2513 16.0596 7.24895 numMergedOcc 0
28 mol 212 unq 3 iso 0 dist 6.29767 8.69988 12.8059 3.9436 5.50658 9.10288 8.55903 10.7914 6.18191 6.19798 numMergedOcc 0
29 mol 212 unq 4 iso 0 dist 6.29767 8.69988 12.8059 3.9436 5.50658 9.10288 10.6618 10.2513 9.88475 7.24895 numMergedOcc 0
30 mol 212 unq 5 iso 0 dist 6.29767 8.55903 10.7914 3.9436 5.50658 6.19798 8.69988 12.8059 6.18191 9.10288 numMergedOcc 0
31 mol 212 unq 6 iso 0 dist 6.29767 8.55903 10.7914 3.9436 5.50658 6.19798 10.6618 10.2513 4.36986 7.24895 numMergedOcc 0
32 mol 212 unq 7 iso 0 dist 6.29767 7.15603 9.63281 3.9436 5.50658 9.32123 8.69988 12.8059 7.34372 9.10288 numMergedOcc 0
33 mol 212 unq 8 iso 0 dist 6.29767 7.15603 9.63281 3.9436 5.50658 9.32123 8.55903 10.7914 10.7093 6.19798 numMergedOcc 0
34 mol 212 unq 9 iso 0 dist 6.29767 7.15603 9.63281 3.9436 5.50658 9.32123 10.6618 10.2513 12.7449 7.24895 numMergedOcc 0
35 mol 212 unq 10 iso 0 dist 8.74585 9.74144 15.1535 3.9436 9.22129 12.0526 8.69988 4.21442 12.5482 9.10288 numMergedOcc 0
36 mol 212 unq 11 iso 0 dist 8.74585 9.74144 15.1535 3.9436 9.22129 12.0526 8.55903 6.69225 15.0034 6.19798 numMergedOcc 0
37 mol 212 unq 12 iso 0 dist 8.74585 9.74144 15.1535 3.9436 9.22129 12.0526 10.6618 11.0496 16.0596 7.24895 numMergedOcc 0
38 mol 212 unq 13 iso 0 dist 8.74585 8.69988 4.21442 3.9436 9.22129 9.10288 8.55903 6.69225 6.18191 6.19798 numMergedOcc 0
39 mol 212 unq 14 iso 0 dist 8.74585 8.69988 4.21442 3.9436 9.22129 9.10288 10.6618 11.0496 9.88475 7.24895 numMergedOcc 0
40 mol 212 unq 15 iso 0 dist 8.74585 8.55903 6.69225 3.9436 9.22129 6.19798 8.69988 4.21442 6.18191 9.10288 numMergedOcc 0
41 mol 212 unq 16 iso 0 dist 8.74585 8.55903 6.69225 3.9436 9.22129 6.19798 10.6618 11.0496 4.36986 7.24895 numMergedOcc 0
42 mol 212 unq 17 iso 0 dist 8.74585 7.15603 10.1399 3.9436 9.22129 9.32123 8.69988 4.21442 7.34372 9.10288 numMergedOcc 0
43 mol 212 unq 18 iso 0 dist 8.74585 7.15603 10.1399 3.9436 9.22129 9.32123 8.55903 6.69225 10.7093 6.19798 numMergedOcc 0
44 mol 212 unq 19 iso 0 dist 8.74585 7.15603 10.1399 3.9436 9.22129 9.32123 10.6618 11.0496 12.7449 7.24895 numMergedOcc 0
45 mol 224 unq 0 iso 0 dist 8.37597 9.51597 10.1672 5.13732 8.54702 10.7847 10.0553 10.0385 13.6892 5.05368 numMergedOcc 0
46 mol 227 unq 0 iso 0 dist 8.03442 7.43071 12.8075 5.0317 9.43618 9.18728 5.41321 4.59123 11.362 8.91971 numMergedOcc 0
47 mol 227 unq 1 iso 0 dist 8.03442 5.41321 4.59123 5.0317 9.43618 8.91971 7.43071 12.8075 11.362 9.18728 numMergedOcc 0
48 mol 279 unq 0 iso 0 dist 6.43341 9.09855 5.89415 4.14939 7.37478 8.98854 10.6879 15.1378 13.3172 9.42255 numMergedOcc 0
