0 mol 15 unq 0 iso 0 dist 8.0637 9.63035 8.9488 7.38118 5.70754 13.2053 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 4.70023 6.48849 5.24207 5.70763 8.02671 11.8248 numMergedOcc 0
2 mol 18 unq 1 iso 0 dist 4.70023 6.48849 5.24207 5.79003 6.09533 10.7939 numMergedOcc 0
3 mol 28 unq 0 iso 0 dist 6.53312 7.61643 8.84112 6.95803 8.76224 12.5879 numMergedOcc 0
4 mol 28 unq 1 iso 0 dist 5.9948 8.85208 8.84112 4.3475 8.76224 12.5879 numMergedOcc 0
5 mol 28 unq 2 iso 0 dist 5.9948 9.04974 4.31273 4.3475 8.76224 10.9751 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 4.85282 4.93315 5.02909 4.85685 6.35779 8.96898 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 5.77675 7.72671 5.66613 5.88789 8.4702 9.10001 numMergedOcc 0
8 mol 88 unq 0 iso 0 dist 9.79535 9.05693 15.8666 13.8801 8.56269 21.9104 numMergedOcc 0
9 mol 88 unq 1 iso 0 dist 9.79535 9.05693 15.8666 7.19267 9.40699 14.7509 numMergedOcc 0
10 mol 88 unq 2 iso 0 dist 9.79535 7.45361 9.40927 13.8801 8.56269 16.023 numMergedOcc 0
11 mol 88 unq 3 iso 0 dist 9.79535 7.45361 9.40927 7.19267 9.40699 5.60174 numMergedOcc 0
12 mol 99 unq 0 iso 0 dist 5.64099 7.55765 4.95662 4.19068 7.80019 10.6842 numMergedOcc 0
13 mol 103 unq 0 iso 0 dist 8.8763 7.4713 10.1927 7.6171 5.53454 9.70231 numMergedOcc 0
14 mol 103 unq 1 iso 0 dist 8.8763 8.91952 12.8681 7.6171 5.53454 15.0168 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 7.7195 7.38306 14.8177 4.71092 7.06555 10.7556 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 5.07395 8.10747 7.8713 9.59663 9.49242 6.58557 numMergedOcc 0
17 mol 210 unq 1 iso 0 dist 5.07395 8.10747 7.8713 13.6676 9.25184 13.6322 numMergedOcc 0
18 mol 243 unq 0 iso 0 dist 9.6748 9.87759 19.1894 6.56644 6.46793 14.3054 numMergedOcc 0
19 mol 243 unq 1 iso 0 dist 9.6748 6.0854 15.5949 6.56644 6.46793 11.0672 numMergedOcc 0
20 mol 243 unq 2 iso 0 dist 9.6748 7.86504 16.6342 6.56644 6.46793 12.8459 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 5.3435 9.64956 13.8539 11.4781 6.61322 19.2493 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 4.76689 8.67835 9.87568 5.30931 7.88108 12.6573 numMergedOcc 0
23 mol 260 unq 1 iso 0 dist 4.76689 8.67835 9.87568 7.91474 9.46576 4.76164 numMergedOcc 0
24 mol 260 unq 2 iso 0 dist 8.79012 5.72892 12.3866 8.90225 7.88108 9.53846 numMergedOcc 0
25 mol 260 unq 3 iso 0 dist 8.79012 5.72892 12.3866 4.38276 9.46576 9.50592 numMergedOcc 0
26 mol 270 unq 0 iso 0 dist 4.60602 6.17797 9.50342 9.89802 7.97614 16.0409 numMergedOcc 0
