0 mol 73 unq 0 iso 0 dist 9.38498 9.73086 17.4121 5.4148 10.2049 7.4369 8.00278 16.2514 8.95637 10.4159 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 9.96396 9.73086 5.70116 5.4148 6.19304 7.4369 8.00278 13.1245 8.95637 10.4159 numMergedOcc 0
2 mol 73 unq 2 iso 0 dist 6.19304 7.4369 5.70116 5.4148 9.96396 9.73086 10.4159 13.1245 8.95637 8.00278 numMergedOcc 0
3 mol 73 unq 3 iso 0 dist 9.75218 9.73086 14.844 5.4148 11.6369 7.4369 8.00278 16.0336 8.95637 10.4159 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 9.03572 8.27883 4.99174 6.59884 11.5113 7.7152 9.82384 12.3553 7.64172 3.67426 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 8.83255 8.27883 8.67311 6.59884 12.9844 7.7152 9.82384 14.5025 7.64172 3.67426 numMergedOcc 0
6 mol 95 unq 2 iso 0 dist 8.03644 8.27883 15.6249 6.59884 11.3446 7.7152 9.82384 14.6852 7.64172 3.67426 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.73993 7.64052 9.68677 9.93257 16.4353 8.95212 6.42493 11.8946 4.22806 7.36889 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 8.73993 7.64052 9.68677 4.85907 10.3704 6.99446 6.42493 11.8946 4.22806 4.55137 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 9.87172 6.99446 6.20019 10.9871 13.9919 8.95212 4.55137 8.20715 4.22806 7.36889 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 9.87172 6.99446 6.20019 4.85907 12.6489 7.64052 4.55137 8.20715 4.22806 6.42493 numMergedOcc 0
11 mol 119 unq 4 iso 0 dist 6.18601 8.95212 4.39676 10.9871 10.1813 6.99446 7.36889 6.16081 4.22806 4.55137 numMergedOcc 0
12 mol 119 unq 5 iso 0 dist 6.18601 8.95212 4.39676 9.93257 9.72413 7.64052 7.36889 6.16081 4.22806 6.42493 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 8.94367 9.33094 7.41373 6.81259 9.86662 8.69531 11.0384 13.0397 6.71328 12.3235 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 6.37586 9.33094 10.8635 6.81259 9.71307 8.69531 11.0384 14.911 6.71328 12.3235 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 6.49416 9.33094 12.3479 6.81259 12.5075 8.69531 11.0384 14.2176 6.71328 12.3235 numMergedOcc 0
16 mol 134 unq 3 iso 0 dist 9.86662 9.1998 12.8086 11.6064 15.281 6.42772 12.3235 13.0397 5.35285 4.87167 numMergedOcc 0
17 mol 134 unq 4 iso 0 dist 9.86662 9.1998 12.8086 7.09823 14.0375 8.70621 12.3235 13.0397 5.35285 13.8191 numMergedOcc 0
18 mol 134 unq 5 iso 0 dist 9.86662 8.69531 7.41373 6.81259 8.94367 9.33094 12.3235 13.0397 6.71328 11.0384 numMergedOcc 0
19 mol 134 unq 6 iso 0 dist 9.71307 9.1998 15.0225 11.6064 15.6507 6.42772 12.3235 14.911 5.35285 4.87167 numMergedOcc 0
20 mol 134 unq 7 iso 0 dist 9.71307 9.1998 15.0225 7.09823 15.9508 8.70621 12.3235 14.911 5.35285 13.8191 numMergedOcc 0
21 mol 134 unq 8 iso 0 dist 9.71307 8.69531 10.8635 6.81259 6.37586 9.33094 12.3235 14.911 6.71328 11.0384 numMergedOcc 0
22 mol 142 unq 0 iso 0 dist 9.2313 7.81207 4.67662 5.32922 5.31024 6.14151 6.05056 10.1107 7.80044 6.24222 numMergedOcc 0
23 mol 142 unq 1 iso 0 dist 5.31024 6.14151 4.67662 5.32922 9.2313 7.81207 6.24222 10.1107 7.80044 6.05056 numMergedOcc 0
24 mol 142 unq 2 iso 0 dist 7.73169 7.81207 5.81599 5.32922 7.26382 6.14151 6.05056 11.3512 7.80044 6.24222 numMergedOcc 0
25 mol 142 unq 3 iso 0 dist 7.26382 6.14151 5.81599 5.32922 7.73169 7.81207 6.24222 11.3512 7.80044 6.05056 numMergedOcc 0
26 mol 142 unq 4 iso 0 dist 8.96657 7.81207 11.1 5.32922 11.0824 6.14151 6.05056 14.5043 7.80044 6.24222 numMergedOcc 0
27 mol 167 unq 0 iso 0 dist 9.87651 7.02548 11.6011 4.70068 12.4733 6.84752 12.6156 20.1435 9.12343 11.8729 numMergedOcc 0
28 mol 167 unq 1 iso 0 dist 9.87651 7.02548 11.6011 10.3445 17.5366 7.86563 12.6156 20.1435 9.12343 9.01215 numMergedOcc 0
29 mol 186 unq 0 iso 0 dist 7.54065 6.61112 11.0961 7.09479 14.4482 8.90571 4.527 9.83935 7.54492 5.88779 numMergedOcc 0
30 mol 192 unq 0 iso 0 dist 5.59424 5.64942 6.35474 5.76246 7.00794 6.97962 6.22871 10.1596 8.70333 4.35125 numMergedOcc 0
31 mol 192 unq 1 iso 0 dist 7.00794 6.97962 6.35474 5.76246 5.59424 5.64942 4.35125 10.1596 8.70333 6.22871 numMergedOcc 0
32 mol 227 unq 0 iso 0 dist 7.22101 5.23634 5.0317 5.22356 8.65997 6.91318 6.16261 9.68793 8.60053 11.3848 numMergedOcc 0
33 mol 227 unq 1 iso 0 dist 8.65997 6.91318 5.0317 5.22356 7.22101 5.23634 11.3848 9.68793 8.60053 6.16261 numMergedOcc 0
34 mol 227 unq 2 iso 0 dist 7.09863 5.23634 5.83175 5.22356 10.8157 6.91318 6.16261 6.40086 8.60053 11.3848 numMergedOcc 0
35 mol 239 unq 0 iso 0 dist 6.16342 6.73665 10.6736 11.347 16.5158 9.34438 11.1638 12.8022 9.24224 17.8983 numMergedOcc 0
36 mol 239 unq 1 iso 0 dist 6.16342 6.73665 10.6736 7.97994 13.7154 9.35949 11.1638 12.8022 9.24224 11.656 numMergedOcc 0
37 mol 277 unq 0 iso 0 dist 9.7748 6.92711 14.772 7.08227 16.3537 5.13913 13.9518 20.2102 9.80035 9.22087 numMergedOcc 0
