0 mol 0 unq 0 iso 0 dist 7.96742 5.55156 11.962 7.1599 15.0192 7.15528 14.4883 22.0525 10.4498 9.23213 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.96742 5.55156 11.962 7.1599 15.0192 7.15528 9.45712 15.1979 5.52201 8.81979 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 8.24206 9.5614 13.3337 5.25456 7.37981 7.15528 13.7029 10.169 10.4498 9.23213 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 8.24206 9.5614 13.3337 5.25456 7.37981 7.15528 10.4777 11.9257 5.52201 8.81979 numMergedOcc 0
4 mol 0 unq 4 iso 0 dist 6.19218 9.5614 6.83587 5.25456 7.19621 7.15528 13.7029 11.8799 10.4498 9.23213 numMergedOcc 0
5 mol 0 unq 5 iso 0 dist 6.19218 9.5614 6.83587 5.25456 7.19621 7.15528 10.4777 5.13546 5.52201 8.81979 numMergedOcc 0
6 mol 0 unq 6 iso 0 dist 7.19397 5.55156 6.83587 7.1599 7.19621 7.15528 14.4883 11.8799 10.4498 9.23213 numMergedOcc 0
7 mol 0 unq 7 iso 0 dist 7.19397 5.55156 6.83587 7.1599 7.19621 7.15528 9.45712 5.13546 5.52201 8.81979 numMergedOcc 0
8 mol 7 unq 0 iso 0 dist 8.0166 6.22805 5.70161 6.96396 12.2471 7.10621 13.6699 16.4537 10.789 7.31201 numMergedOcc 0
9 mol 7 unq 1 iso 0 dist 8.0166 6.22805 5.70161 6.96396 12.2471 7.10621 13.3157 15.401 10.515 9.36807 numMergedOcc 0
10 mol 7 unq 2 iso 0 dist 9.32945 6.22805 4.57188 6.96396 10.2729 7.10621 13.6699 13.1295 10.789 7.31201 numMergedOcc 0
11 mol 7 unq 3 iso 0 dist 9.32945 6.22805 4.57188 6.96396 10.2729 7.10621 13.3157 14.1116 10.515 9.36807 numMergedOcc 0
12 mol 7 unq 4 iso 0 dist 9.90117 6.22805 6.09254 6.96396 7.21217 7.10621 13.6699 9.17096 10.789 7.31201 numMergedOcc 0
13 mol 7 unq 5 iso 0 dist 9.90117 6.22805 6.09254 6.96396 7.21217 7.10621 13.3157 12.4418 10.515 9.36807 numMergedOcc 0
14 mol 16 unq 0 iso 0 dist 7.88676 7.46752 6.53177 5.66097 5.84479 7.63133 9.47421 5.1298 5.94084 5.47769 numMergedOcc 0
15 mol 16 unq 1 iso 0 dist 7.88676 7.46752 6.53177 6.06561 8.67719 5.46498 9.47421 5.1298 5.94084 6.58035 numMergedOcc 0
16 mol 16 unq 2 iso 0 dist 7.88676 7.46752 6.53177 6.06561 8.67719 5.46498 12.3246 13.18 6.73355 8.41862 numMergedOcc 0
17 mol 16 unq 3 iso 0 dist 7.88676 7.46752 6.53177 8.02077 13.4596 8.71745 12.3246 13.18 6.73355 8.16785 numMergedOcc 0
18 mol 75 unq 0 iso 0 dist 7.89636 7.118 6.33557 5.06305 10.6919 7.79912 9.77241 14.7276 10.0425 5.15851 numMergedOcc 0
19 mol 75 unq 1 iso 0 dist 7.89636 8.24814 4.67917 5.06305 10.6919 8.56639 9.77241 14.7276 11.8774 5.15851 numMergedOcc 0
20 mol 75 unq 2 iso 0 dist 9.49608 7.118 9.95193 5.06305 11.1009 7.79912 9.77241 15.4468 10.0425 5.15851 numMergedOcc 0
21 mol 75 unq 3 iso 0 dist 9.49608 8.24814 5.10798 5.06305 11.1009 8.56639 9.77241 15.4468 11.8774 5.15851 numMergedOcc 0
22 mol 100 unq 0 iso 0 dist 6.60356 9.57498 14.3495 6.89762 11.5472 6.45675 6.0026 8.57632 7.2495 8.72704 numMergedOcc 0
23 mol 102 unq 0 iso 0 dist 8.63522 9.0361 10.2218 7.49575 12.8661 7.36792 6.793 7.99081 5.498 9.94856 numMergedOcc 0
24 mol 102 unq 1 iso 0 dist 5.43401 9.0361 8.17186 7.49575 9.10229 7.36792 6.793 6.83631 5.498 9.94856 numMergedOcc 0
25 mol 114 unq 0 iso 0 dist 5.31281 9.24515 7.18757 5.24877 8.42445 7.5732 11.3006 10.453 5.80557 8.71128 numMergedOcc 0
26 mol 114 unq 1 iso 0 dist 8.9922 9.24515 7.13921 5.24877 10.2889 7.5732 11.3006 7.37521 5.80557 8.71128 numMergedOcc 0
27 mol 115 unq 0 iso 0 dist 7.67341 8.93552 11.909 6.07331 11.6732 4.99221 12.1661 15.5439 5.60178 6.50039 numMergedOcc 0
28 mol 127 unq 0 iso 0 dist 8.98151 6.65963 5.38 10.345 12.4667 8.14887 18.5156 17.894 14.9761 8.59981 numMergedOcc 0
29 mol 127 unq 1 iso 0 dist 8.98151 6.65963 5.38 10.345 12.4667 8.14887 11.9686 12.2963 7.41404 7.34519 numMergedOcc 0
30 mol 127 unq 2 iso 0 dist 8.98151 8.62711 6.75619 10.345 12.4667 9.30299 18.5156 17.894 14.085 8.59981 numMergedOcc 0
31 mol 127 unq 3 iso 0 dist 8.98151 8.62711 6.75619 10.345 12.4667 9.30299 11.9686 12.2963 13.1312 7.34519 numMergedOcc 0
32 mol 175 unq 0 iso 0 dist 8.6609 6.73365 6.15969 5.73338 10.7272 5.6234 15.0771 16.3235 10.5631 9.8589 numMergedOcc 0
33 mol 175 unq 1 iso 0 dist 8.6609 6.73365 6.15969 12.753 14.7648 9.92231 15.0771 16.3235 10.5631 7.24908 numMergedOcc 0
34 mol 175 unq 2 iso 0 dist 8.6609 9.45659 11.0866 5.73338 10.7272 6.57069 15.0771 16.3235 7.5414 9.8589 numMergedOcc 0
35 mol 175 unq 3 iso 0 dist 6.21546 6.73365 5.50014 5.73338 8.69888 5.6234 15.0771 14.6255 10.5631 9.8589 numMergedOcc 0
36 mol 175 unq 4 iso 0 dist 6.21546 6.73365 5.50014 12.753 14.9263 9.92231 15.0771 14.6255 10.5631 7.24908 numMergedOcc 0
37 mol 175 unq 5 iso 0 dist 6.21546 9.45659 7.39186 5.73338 8.69888 6.57069 15.0771 14.6255 7.5414 9.8589 numMergedOcc 0
38 mol 175 unq 6 iso 0 dist 6.03184 6.73365 7.28617 5.73338 5.08206 5.6234 15.0771 11.5085 10.5631 9.8589 numMergedOcc 0
39 mol 175 unq 7 iso 0 dist 6.03184 6.73365 7.28617 12.753 11.7895 9.92231 15.0771 11.5085 10.5631 7.24908 numMergedOcc 0
40 mol 175 unq 8 iso 0 dist 6.03184 9.45659 5.77256 5.73338 5.08206 6.57069 15.0771 11.5085 7.5414 9.8589 numMergedOcc 0
41 mol 181 unq 0 iso 0 dist 6.47689 9.63295 5.16386 12.5935 11.5992 7.63312 18.3583 14.5433 9.60512 7.98142 numMergedOcc 0
42 mol 181 unq 1 iso 0 dist 6.47689 9.63295 5.16386 12.5935 11.5992 7.63312 19.9229 18.0588 13.3389 7.37327 numMergedOcc 0
43 mol 224 unq 0 iso 0 dist 7.62593 4.79841 5.41021 11.4653 9.33771 8.95269 11.4157 11.498 7.98696 6.87664 numMergedOcc 0
44 mol 236 unq 0 iso 0 dist 9.13126 6.73134 6.0258 5.27568 12.9448 8.35971 5.77356 10.3827 6.40312 7.17676 numMergedOcc 0
45 mol 236 unq 1 iso 0 dist 9.13126 6.73134 6.0258 5.27568 12.9448 8.35971 9.24309 12.2148 6.2568 6.68463 numMergedOcc 0
46 mol 238 unq 0 iso 0 dist 6.74214 7.98022 6.62361 6.3873 9.31417 5.72887 14.7533 18.4149 13.069 9.29858 numMergedOcc 0
47 mol 238 unq 1 iso 0 dist 5.33462 7.98022 5.96552 6.3873 5.56719 5.72887 14.7533 14.7671 13.069 9.29858 numMergedOcc 0
48 mol 248 unq 0 iso 0 dist 8.11968 6.44967 4.53213 9.48478 8.71859 7.69895 9.83514 4.11367 6.48757 6.07192 numMergedOcc 0
49 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 12.7595 9.58006 7.88519 15.1733 15.1483 11.6195 7.48005 numMergedOcc 0
50 mol 261 unq 0 iso 0 dist 9.70222 7.6414 11.544 13.6041 17.2791 8.45658 12.6505 13.8787 5.22253 7.47164 numMergedOcc 0
51 mol 282 unq 0 iso 0 dist 7.93511 6.84554 4.58403 9.67023 5.67266 8.76532 13.2331 5.41716 8.14825 8.8673 numMergedOcc 0
52 mol 282 unq 1 iso 0 dist 7.93511 9.51581 5.04235 9.67023 5.67266 6.33524 13.2331 5.41716 7.36881 8.8673 numMergedOcc 0
53 mol 282 unq 2 iso 0 dist 5.62497 8.58671 4.85461 8.13794 9.63346 8.04483 15.6696 14.5422 10.1236 8.8673 numMergedOcc 0
