0 mol 16 unq 0 iso 0 dist 7.63133 6.31718 10.8455 5.47769 5.94084 6.2983 10.454 6.56335 15.6697 11.6017 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 6.864 4.51865 7.67038 8.58657 5.5841 6.74265 9.47529 6.92532 10.1882 11.2198 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.80331 6.20293 8.13395 9.83618 10.4442 9.49077 9.06158 9.93832 8.60739 16.8624 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 6.20293 8.80331 8.13395 9.83618 9.49077 10.4442 9.06158 8.60739 9.93832 16.8624 numMergedOcc 0
4 mol 52 unq 0 iso 0 dist 7.34143 9.80098 9.162 7.18176 4.5482 5.93337 8.9759 9.9052 16.7829 13.3077 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 6.19965 7.97049 5.42586 9.47876 11.6116 7.98917 7.91778 7.33422 12.3486 16.0288 numMergedOcc 0
6 mol 85 unq 1 iso 0 dist 7.66905 7.47541 5.42586 7.22293 11.6116 7.98917 10.121 7.33422 12.3486 16.0288 numMergedOcc 0
7 mol 85 unq 2 iso 0 dist 7.66905 5.73196 10.1164 7.22293 11.6116 6.47779 10.121 7.33422 14.9249 16.0288 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 7.47343 6.65086 8.8807 7.75343 15.209 10.9608 14.9392 9.00544 17.8663 22.2111 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 7.47343 6.65086 8.8807 7.75343 15.209 10.9608 12.6602 7.12017 12.6061 19.9317 numMergedOcc 0
10 mol 100 unq 2 iso 0 dist 7.47343 6.56369 12.6515 7.75343 15.209 5.69137 14.9392 9.00544 20.2183 22.2111 numMergedOcc 0
11 mol 100 unq 3 iso 0 dist 7.47343 6.56369 12.6515 7.75343 15.209 5.69137 12.6602 7.12017 18.4011 19.9317 numMergedOcc 0
12 mol 100 unq 4 iso 0 dist 7.47343 9.30209 13.887 7.75343 15.209 9.21622 14.9392 9.00544 22.6977 22.2111 numMergedOcc 0
13 mol 100 unq 5 iso 0 dist 7.47343 9.30209 13.887 7.75343 15.209 9.21622 12.6602 7.12017 17.8494 19.9317 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 5.83991 9.33865 7.69052 7.76729 10.9739 10.7942 6.4497 5.72642 10.9734 14.0242 numMergedOcc 0
15 mol 115 unq 1 iso 0 dist 6.11741 9.33865 8.02349 9.66954 4.61908 6.09023 6.08806 5.74857 10.9766 9.62857 numMergedOcc 0
16 mol 115 unq 2 iso 0 dist 6.11741 9.33865 8.02349 7.64585 10.8939 10.2377 6.08806 5.74857 10.9766 13.5029 numMergedOcc 0
17 mol 115 unq 3 iso 0 dist 7.88312 7.30858 11.5723 8.66155 4.61908 11.3902 7.21418 5.74857 10.0289 9.62857 numMergedOcc 0
18 mol 115 unq 4 iso 0 dist 7.88312 5.83991 8.02349 8.66155 4.61908 6.09023 7.21418 5.74857 10.9766 9.62857 numMergedOcc 0
19 mol 115 unq 5 iso 0 dist 7.88312 6.11741 7.69052 6.99777 11.7126 10.8292 7.3094 5.72642 10.9734 9.9928 numMergedOcc 0
20 mol 115 unq 6 iso 0 dist 7.88312 6.11741 7.69052 9.14376 4.62962 6.12943 7.3094 5.72642 10.9734 9.68845 numMergedOcc 0
21 mol 152 unq 0 iso 0 dist 8.56324 6.70283 7.65448 9.13561 5.99333 8.25411 9.35627 9.77552 8.28642 14.187 numMergedOcc 0
22 mol 152 unq 1 iso 0 dist 8.56324 7.16148 10.6875 9.13561 5.99333 7.89109 9.35627 9.77552 13.1536 14.187 numMergedOcc 0
23 mol 152 unq 2 iso 0 dist 6.70283 8.56324 7.65448 9.13561 8.25411 5.99333 9.35627 8.28642 9.77552 14.187 numMergedOcc 0
24 mol 152 unq 3 iso 0 dist 6.70283 7.16148 5.49936 9.13561 8.25411 7.89109 9.35627 8.28642 13.1536 14.187 numMergedOcc 0
25 mol 156 unq 0 iso 0 dist 8.34702 9.06726 6.31306 7.36119 11.787 7.71144 6.44255 9.43259 11.1392 10.8344 numMergedOcc 0
26 mol 156 unq 1 iso 0 dist 8.34702 9.06726 6.31306 7.36119 11.787 7.71144 5.82636 6.2319 9.97732 11.6744 numMergedOcc 0
27 mol 156 unq 2 iso 0 dist 8.34702 8.33171 6.56229 7.36119 11.787 9.22231 6.44255 9.43259 12.8935 10.8344 numMergedOcc 0
28 mol 156 unq 3 iso 0 dist 8.34702 8.33171 6.56229 7.36119 11.787 9.22231 5.82636 6.2319 10.5243 11.6744 numMergedOcc 0
29 mol 156 unq 4 iso 0 dist 9.06726 8.34702 6.31306 7.36119 7.71144 11.787 5.82636 9.97732 6.2319 11.6744 numMergedOcc 0
30 mol 156 unq 5 iso 0 dist 9.06726 8.33171 5.64555 7.36119 7.71144 9.22231 5.82636 9.97732 10.5243 11.6744 numMergedOcc 0
31 mol 181 unq 0 iso 0 dist 5.98885 9.09537 10.1912 7.20046 5.4601 6.14208 5.93488 6.51749 7.20392 7.345 numMergedOcc 0
32 mol 181 unq 1 iso 0 dist 5.98885 9.09537 10.1912 7.13543 10.0524 5.95965 5.93488 6.51749 7.20392 9.52987 numMergedOcc 0
33 mol 181 unq 2 iso 0 dist 9.09537 5.98885 10.1912 7.20046 6.14208 5.4601 5.93488 7.20392 6.51749 7.345 numMergedOcc 0
34 mol 181 unq 3 iso 0 dist 9.09537 5.98885 10.1912 7.13543 5.95965 10.0524 5.93488 7.20392 6.51749 9.52987 numMergedOcc 0
35 mol 205 unq 0 iso 0 dist 6.03031 7.26832 7.38516 9.19704 8.66809 6.23291 5.28092 8.44861 5.60393 5.42696 numMergedOcc 0
36 mol 205 unq 1 iso 0 dist 6.03031 7.80463 8.18714 9.19704 8.66809 13.231 5.28092 8.44861 11.3521 5.42696 numMergedOcc 0
37 mol 205 unq 2 iso 0 dist 7.26832 6.03031 7.38516 9.19704 6.23291 8.66809 5.28092 5.60393 8.44861 5.42696 numMergedOcc 0
38 mol 205 unq 3 iso 0 dist 7.26832 7.80463 13.8543 9.19704 6.23291 13.231 5.28092 5.60393 11.3521 5.42696 numMergedOcc 0
39 mol 227 unq 0 iso 0 dist 7.22101 7.09863 4.39704 8.17891 6.43754 9.13836 10.5813 8.03442 12.2278 7.1372 numMergedOcc 0
40 mol 248 unq 0 iso 0 dist 7.69895 7.21521 5.55137 6.07192 6.48757 5.51827 5.99459 6.17052 9.77666 8.53148 numMergedOcc 0
41 mol 248 unq 1 iso 0 dist 7.69895 8.2965 10.8081 6.07192 6.48757 9.29921 5.99459 6.17052 13.0539 8.53148 numMergedOcc 0
42 mol 248 unq 2 iso 0 dist 7.21521 7.69895 5.55137 6.07192 5.51827 6.48757 5.99459 9.77666 6.17052 8.53148 numMergedOcc 0
43 mol 248 unq 3 iso 0 dist 7.21521 8.2965 5.86196 6.07192 5.51827 9.29921 5.99459 9.77666 13.0539 8.53148 numMergedOcc 0
44 mol 252 unq 0 iso 0 dist 8.1148 8.33025 6.0987 7.66365 4.23801 9.37715 9.32326 6.11473 10.7615 6.57207 numMergedOcc 0
45 mol 252 unq 1 iso 0 dist 8.1148 8.33025 6.0987 7.66365 4.23801 9.37715 5.89666 8.47784 12.0482 5.2361 numMergedOcc 0
46 mol 252 unq 2 iso 0 dist 8.1148 8.33025 6.0987 7.66365 4.23801 9.37715 11.056 6.53679 7.50201 10.1637 numMergedOcc 0
47 mol 252 unq 3 iso 0 dist 8.33025 8.1148 6.0987 7.66365 9.37715 4.23801 11.056 7.50201 6.53679 10.1637 numMergedOcc 0
48 mol 259 unq 0 iso 0 dist 7.46176 7.88519 6.96053 7.48005 5.79468 11.6195 5.60748 8.55558 10.5803 6.39918 numMergedOcc 0
49 mol 259 unq 1 iso 0 dist 7.46176 7.84554 7.64658 7.48005 5.79468 11.8736 5.60748 8.55558 12.4037 6.39918 numMergedOcc 0
50 mol 259 unq 2 iso 0 dist 7.46176 9.18903 10.5239 7.48005 5.79468 12.6649 5.60748 8.55558 14.4498 6.39918 numMergedOcc 0
51 mol 261 unq 0 iso 0 dist 9.14619 8.45658 7.00201 7.47164 7.49174 5.22253 6.04016 5.26434 8.60026 9.24121 numMergedOcc 0
52 mol 261 unq 1 iso 0 dist 8.45658 9.14619 7.00201 7.47164 5.22253 7.49174 6.04016 8.60026 5.26434 9.24121 numMergedOcc 0
53 mol 272 unq 0 iso 0 dist 9.97651 8.46116 8.12676 9.09992 10.841 5.63139 4.86504 9.64269 8.46061 11.7075 numMergedOcc 0
54 mol 272 unq 1 iso 0 dist 9.97651 8.46116 8.12676 6.16449 4.72202 8.52877 4.86504 9.64269 8.46061 7.55161 numMergedOcc 0
55 mol 272 unq 2 iso 0 dist 8.46116 9.97651 8.12676 9.09992 5.63139 10.841 4.86504 8.46061 9.64269 11.7075 numMergedOcc 0
56 mol 272 unq 3 iso 0 dist 8.46116 9.97651 8.12676 6.16449 8.52877 4.72202 4.86504 8.46061 9.64269 7.55161 numMergedOcc 0
