0 mol 1 unq 0 iso 0 dist 6.4181 7.90928 5.11735 6.35409 10.488 8.56884 12.2079 13.3466 9.01967 9.00903 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.36377 9.05346 6.2983 5.48395 6.31718 5.47769 12.9591 10.8455 5.94084 7.63133 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 6.36377 9.05346 6.2983 10.1011 10.9143 6.58035 12.9591 10.8455 5.94084 5.46498 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 7.7978 8.68726 6.7583 10.8906 13.9238 8.24062 10.7681 9.49235 5.3525 7.71095 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 7.7978 8.68726 6.7583 10.8906 13.9238 8.24062 17.118 17.6363 11.0387 8.84665 numMergedOcc 0
5 mol 59 unq 2 iso 0 dist 7.7978 8.68726 6.7583 10.8906 13.9238 8.24062 16.5558 15.6032 9.15805 8.25513 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 7.74197 5.82918 6.95868 4.0486 9.36773 9.2603 7.86537 5.57085 6.97239 8.31336 numMergedOcc 0
7 mol 88 unq 1 iso 0 dist 7.86537 5.82918 6.97239 4.0486 8.31336 9.2603 7.74197 5.57085 6.95868 9.36773 numMergedOcc 0
8 mol 88 unq 2 iso 0 dist 6.35462 5.82918 4.37348 4.0486 10.3436 9.2603 7.74197 9.94966 6.95868 9.36773 numMergedOcc 0
9 mol 88 unq 3 iso 0 dist 6.35462 5.82918 4.37348 4.0486 10.3436 9.2603 7.86537 10.9968 6.97239 8.31336 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 6.48328 5.58063 4.51489 5.24961 9.55515 7.64585 12.5192 14.0903 10.2377 9.33865 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 6.48328 5.58063 4.51489 5.24961 9.55515 7.64585 10.8398 12.5968 10.8939 6.11741 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 6.90827 9.58171 4.91401 10.4485 7.90328 6.62561 18.7881 13.1058 11.3679 9.84395 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 6.7973 9.16944 4.9093 5.01118 6.23493 9.17284 10.6879 5.71071 6.3437 7.46303 numMergedOcc 0
14 mol 155 unq 1 iso 0 dist 4.44292 7.62575 5.40375 14.7279 13.5605 9.86313 13.0657 10.7349 5.86939 6.23493 numMergedOcc 0
15 mol 155 unq 2 iso 0 dist 4.44292 7.62575 5.40375 10.4606 10.7829 7.51198 13.0657 10.7349 5.86939 7.46303 numMergedOcc 0
16 mol 155 unq 3 iso 0 dist 4.44292 7.62575 5.40375 10.4606 10.7829 7.51198 10.6076 10.7616 6.34186 6.43582 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 9.58911 8.45395 10.5753 9.47799 9.94371 6.94688 9.86845 6.01247 6.25083 9.1374 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 9.58911 8.45395 10.5753 9.47799 9.94371 6.94688 13.0329 12.6324 5.86342 5.98885 numMergedOcc 0
19 mol 181 unq 2 iso 0 dist 9.58911 8.45395 10.5753 9.47799 9.94371 6.94688 14.039 16.5106 6.80228 9.15386 numMergedOcc 0
20 mol 181 unq 3 iso 0 dist 9.58911 5.41368 5.88819 9.47799 9.94371 6.71012 9.86845 6.01247 4.77278 9.1374 numMergedOcc 0
21 mol 181 unq 4 iso 0 dist 9.58911 5.41368 5.88819 9.47799 9.94371 6.71012 13.0329 12.6324 9.14057 5.98885 numMergedOcc 0
22 mol 181 unq 5 iso 0 dist 9.58911 5.41368 5.88819 9.47799 9.94371 6.71012 14.039 16.5106 11.6919 9.15386 numMergedOcc 0
23 mol 181 unq 6 iso 0 dist 7.41378 5.83596 8.35755 4.3226 9.81747 4.93785 10.8641 11.5866 6.7991 7.81386 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 7.85877 7.35476 12.2813 4.82768 7.21333 6.82208 10.8522 13.3522 4.8892 8.01589 numMergedOcc 0
25 mol 222 unq 1 iso 0 dist 7.85877 7.35476 12.2813 4.82768 7.21333 6.82208 10.0664 5.24516 11.0074 7.7699 numMergedOcc 0
26 mol 236 unq 0 iso 0 dist 5.66569 6.98151 6.04825 11.2013 9.99038 7.17676 12.3675 9.90963 11.8759 8.03456 numMergedOcc 0
27 mol 236 unq 1 iso 0 dist 5.66569 6.98151 6.04825 11.2013 9.99038 7.17676 11.0771 11.3368 11.3552 6.84306 numMergedOcc 0
28 mol 236 unq 2 iso 0 dist 5.66569 6.98151 6.04825 11.2013 9.99038 7.17676 15.7385 11.1557 12.6468 9.78037 numMergedOcc 0
29 mol 236 unq 3 iso 0 dist 5.66569 6.98151 6.04825 11.2013 9.99038 7.17676 13.3367 10.7497 6.40312 8.35971 numMergedOcc 0
30 mol 236 unq 4 iso 0 dist 5.66569 6.98151 6.04825 4.15973 6.27581 5.34718 12.3675 9.90963 11.8759 9.81562 numMergedOcc 0
31 mol 236 unq 5 iso 0 dist 5.66569 6.98151 6.04825 4.15973 6.27581 5.34718 11.0771 11.3368 11.3552 7.68742 numMergedOcc 0
32 mol 238 unq 0 iso 0 dist 6.24928 8.81534 6.20606 9.85437 11.101 6.55759 11.3074 14.0328 10.4664 7.31233 numMergedOcc 0
33 mol 238 unq 1 iso 0 dist 8.59074 9.46582 13.7993 9.23693 14.6111 7.67322 14.9617 17.126 12.6986 7.31233 numMergedOcc 0
