0 mol 56 unq 0 iso 0 dist 9.39338 9.10096 9.23822 9.80869 6.66024 9.20886 numMergedOcc 0
1 mol 66 unq 0 iso 0 dist 8.58798 8.63436 5.90568 6.32532 5.1493 4.57519 numMergedOcc 0
2 mol 93 unq 0 iso 0 dist 9.27407 8.21739 6.10639 9.43355 10.5249 4.97727 numMergedOcc 0
3 mol 93 unq 1 iso 0 dist 9.27407 8.21739 6.10639 5.64141 10.3971 5.77343 numMergedOcc 0
4 mol 93 unq 2 iso 0 dist 9.27407 8.21739 6.10639 5.46186 8.75661 11.0802 numMergedOcc 0
5 mol 93 unq 3 iso 0 dist 9.27407 4.78377 12.8537 9.43355 10.5249 13.8087 numMergedOcc 0
6 mol 93 unq 4 iso 0 dist 9.27407 4.78377 12.8537 5.64141 10.3971 9.96831 numMergedOcc 0
7 mol 93 unq 5 iso 0 dist 9.27407 4.78377 12.8537 5.46186 8.75661 5.33894 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 8.67615 9.70095 10.3606 8.29463 12.9628 12.068 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 7.13657 6.97579 11.0112 4.54218 5.78168 5.25982 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 6.36857 6.96911 12.8348 7.96394 4.77779 14.2552 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 6.36857 6.96911 12.8348 8.01381 11.3698 7.79956 numMergedOcc 0
12 mol 156 unq 2 iso 0 dist 6.36857 9.81276 15.2207 7.96394 4.77779 14.9876 numMergedOcc 0
13 mol 156 unq 3 iso 0 dist 6.36857 9.81276 15.2207 8.01381 11.3698 5.70715 numMergedOcc 0
14 mol 156 unq 4 iso 0 dist 6.78431 6.96911 10.5411 7.96394 9.75616 14.2552 numMergedOcc 0
15 mol 156 unq 5 iso 0 dist 6.78431 6.96911 10.5411 8.01381 10.9946 7.79956 numMergedOcc 0
16 mol 156 unq 6 iso 0 dist 6.78431 9.81276 14.0514 7.96394 9.75616 14.9876 numMergedOcc 0
17 mol 156 unq 7 iso 0 dist 6.78431 9.81276 14.0514 8.01381 10.9946 5.70715 numMergedOcc 0
18 mol 173 unq 0 iso 0 dist 5.15834 9.476 6.41166 5.82174 6.97027 6.38538 numMergedOcc 0
19 mol 173 unq 1 iso 0 dist 5.15834 5.77288 5.5911 5.82174 6.97027 9.14584 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 8.41494 8.78339 13.5474 9.22792 9.09562 16.6117 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 8.41494 8.78339 13.5474 7.85696 8.66219 12.8276 numMergedOcc 0
22 mol 186 unq 2 iso 0 dist 8.41494 8.78339 13.5474 5.00402 9.20585 10.9737 numMergedOcc 0
23 mol 186 unq 3 iso 0 dist 8.41494 8.78339 13.5474 6.17773 9.53136 7.02093 numMergedOcc 0
24 mol 232 unq 0 iso 0 dist 8.24059 6.39295 9.42002 8.22129 9.91412 10.0046 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 8.85872 6.69569 9.33965 9.98518 9.11127 13.2109 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 8.85872 6.69569 9.33965 9.98518 9.11127 13.2109 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 8.85872 6.69569 9.33965 9.98518 9.11127 13.2109 numMergedOcc 0
