0 mol 26 unq 0 iso 0 dist 9.12845 14.1424 9.06516 5.30734 6.38243 14.3325 6.04762 6.81793 11.553 5.66783 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.12845 6.10146 9.96121 5.30734 6.38243 8.13684 6.04762 6.81793 10.8434 5.66783 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 7.06939 6.61299 9.39807 6.08245 6.9223 7.24263 9.44576 6.87506 6.23341 8.67827 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 7.06939 6.61299 9.39807 6.86728 7.0561 12.5937 9.44576 6.87506 6.23341 13.0818 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 5.10496 8.70415 6.61111 7.32662 8.75597 13.6622 7.94178 9.84703 10.2677 8.02554 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 5.10496 8.70415 6.61111 7.32662 8.75597 13.6622 4.4057 4.62494 5.71029 11.2092 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 5.10496 8.70415 6.61111 12.3881 9.18457 6.34014 7.94178 9.84703 10.2677 16.2968 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 5.10496 8.70415 6.61111 12.3881 9.18457 6.34014 4.4057 4.62494 5.71029 8.26478 numMergedOcc 0
8 mol 98 unq 4 iso 0 dist 9.64383 12.0058 4.44979 8.76845 6.83746 5.92812 18.5442 9.25444 10.2677 14.6934 numMergedOcc 0
9 mol 98 unq 5 iso 0 dist 9.64383 12.0058 4.44979 8.76845 6.83746 5.92812 16.4267 8.46823 5.71029 11.4207 numMergedOcc 0
10 mol 98 unq 6 iso 0 dist 9.64383 12.0058 4.44979 11.7715 9.14707 6.34014 16.4267 8.46823 5.71029 8.26478 numMergedOcc 0
11 mol 98 unq 7 iso 0 dist 9.64383 12.0058 4.44979 11.7715 9.14707 6.34014 18.5442 9.25444 10.2677 16.2968 numMergedOcc 0
12 mol 98 unq 8 iso 0 dist 5.92242 9.74284 6.61111 13.4985 8.75597 13.6622 15.7178 9.84703 10.2677 8.02554 numMergedOcc 0
13 mol 98 unq 9 iso 0 dist 5.92242 9.74284 6.61111 13.4985 8.75597 13.6622 7.42446 4.62494 5.71029 11.2092 numMergedOcc 0
14 mol 98 unq 10 iso 0 dist 5.92242 9.74284 6.61111 7.89505 9.18457 6.34014 15.7178 9.84703 10.2677 16.2968 numMergedOcc 0
15 mol 98 unq 11 iso 0 dist 5.92242 9.74284 6.61111 7.89505 9.18457 6.34014 7.42446 4.62494 5.71029 8.26478 numMergedOcc 0
16 mol 98 unq 12 iso 0 dist 7.54889 10.0962 4.44979 13.9572 6.83746 5.92812 9.85543 9.25444 10.2677 14.6934 numMergedOcc 0
17 mol 98 unq 13 iso 0 dist 7.54889 10.0962 4.44979 13.9572 6.83746 5.92812 9.67482 8.46823 5.71029 11.4207 numMergedOcc 0
18 mol 98 unq 14 iso 0 dist 7.54889 10.0962 4.44979 13.1975 9.14707 6.34014 9.67482 8.46823 5.71029 8.26478 numMergedOcc 0
19 mol 98 unq 15 iso 0 dist 7.54889 10.0962 4.44979 13.1975 9.14707 6.34014 9.85543 9.25444 10.2677 16.2968 numMergedOcc 0
20 mol 98 unq 16 iso 0 dist 5.2571 10.0962 6.61111 6.934 8.75597 13.6622 9.85543 9.84703 10.2677 8.02554 numMergedOcc 0
21 mol 98 unq 17 iso 0 dist 5.2571 10.0962 6.61111 6.934 8.75597 13.6622 9.67482 4.62494 5.71029 11.2092 numMergedOcc 0
22 mol 98 unq 18 iso 0 dist 5.2571 10.0962 6.61111 13.1975 9.18457 6.34014 9.85543 9.84703 10.2677 16.2968 numMergedOcc 0
23 mol 98 unq 19 iso 0 dist 5.2571 10.0962 6.61111 13.1975 9.18457 6.34014 9.67482 4.62494 5.71029 8.26478 numMergedOcc 0
24 mol 98 unq 20 iso 0 dist 7.78931 11.2452 4.44979 14.5341 6.83746 5.92812 7.28361 9.25444 10.2677 14.6934 numMergedOcc 0
25 mol 98 unq 21 iso 0 dist 7.78931 11.2452 4.44979 14.5341 6.83746 5.92812 12.0974 8.46823 5.71029 11.4207 numMergedOcc 0
26 mol 98 unq 22 iso 0 dist 7.78931 11.2452 4.44979 15.9953 9.14707 6.34014 12.0974 8.46823 5.71029 8.26478 numMergedOcc 0
27 mol 98 unq 23 iso 0 dist 7.78931 11.2452 4.44979 15.9953 9.14707 6.34014 7.28361 9.25444 10.2677 16.2968 numMergedOcc 0
28 mol 98 unq 24 iso 0 dist 8.7497 11.2452 6.61111 7.17433 8.75597 13.6622 7.28361 9.84703 10.2677 8.02554 numMergedOcc 0
29 mol 98 unq 25 iso 0 dist 8.7497 11.2452 6.61111 7.17433 8.75597 13.6622 12.0974 4.62494 5.71029 11.2092 numMergedOcc 0
30 mol 98 unq 26 iso 0 dist 8.7497 11.2452 6.61111 15.9953 9.18457 6.34014 7.28361 9.84703 10.2677 16.2968 numMergedOcc 0
31 mol 98 unq 27 iso 0 dist 8.7497 11.2452 6.61111 15.9953 9.18457 6.34014 12.0974 4.62494 5.71029 8.26478 numMergedOcc 0
32 mol 112 unq 0 iso 0 dist 9.05166 6.35364 8.91262 12.6695 7.44041 9.06991 5.76986 8.72725 10.8329 15.0784 numMergedOcc 0
33 mol 119 unq 0 iso 0 dist 8.95212 10.3457 6.13374 13.52 9.57341 11.1324 5.13589 8.67537 7.39626 14.8901 numMergedOcc 0
34 mol 119 unq 1 iso 0 dist 8.95212 16.7975 9.08536 13.52 9.57341 8.96522 5.13589 8.67537 15.4934 14.8901 numMergedOcc 0
35 mol 119 unq 2 iso 0 dist 6.99446 6.35763 6.13374 4.99056 9.57341 11.1324 10.8661 8.67537 7.39626 14.8901 numMergedOcc 0
36 mol 119 unq 3 iso 0 dist 6.99446 7.36192 9.08536 4.99056 9.57341 8.96522 10.8661 8.67537 15.4934 14.8901 numMergedOcc 0
37 mol 119 unq 4 iso 0 dist 7.64052 10.0197 6.13374 3.78311 9.57341 11.1324 12.0175 8.67537 7.39626 14.8901 numMergedOcc 0
38 mol 119 unq 5 iso 0 dist 7.64052 10.6679 9.08536 3.78311 9.57341 8.96522 12.0175 8.67537 15.4934 14.8901 numMergedOcc 0
39 mol 224 unq 0 iso 0 dist 8.08349 10.7113 5.73591 4.59567 8.54702 8.5129 10.7174 5.05368 6.957 10.0385 numMergedOcc 0
40 mol 224 unq 1 iso 0 dist 8.08349 11.4491 8.55345 4.59567 8.54702 7.96876 10.7174 5.05368 7.16077 10.0385 numMergedOcc 0
41 mol 224 unq 2 iso 0 dist 9.78218 11.4252 5.73591 9.48743 8.54702 8.5129 6.51732 5.05368 6.957 10.0385 numMergedOcc 0
42 mol 224 unq 3 iso 0 dist 9.78218 9.14568 8.55345 9.48743 8.54702 7.96876 6.51732 5.05368 7.16077 10.0385 numMergedOcc 0
43 mol 234 unq 0 iso 0 dist 7.81215 5.56749 9.11572 11.113 9.08151 8.16702 10.0059 7.77911 7.17691 9.35405 numMergedOcc 0
44 mol 234 unq 1 iso 0 dist 7.81215 15.015 9.49229 11.113 9.08151 9.70708 10.0059 7.77911 6.51967 9.35405 numMergedOcc 0
45 mol 234 unq 2 iso 0 dist 7.81215 12.1076 7.20293 11.113 9.08151 11.7632 10.0059 7.77911 4.51304 9.35405 numMergedOcc 0
46 mol 234 unq 3 iso 0 dist 5.64285 8.0608 9.11572 5.52595 9.08151 8.16702 5.08515 7.77911 7.17691 9.35405 numMergedOcc 0
47 mol 234 unq 4 iso 0 dist 5.64285 5.34613 9.49229 5.52595 9.08151 9.70708 5.08515 7.77911 6.51967 9.35405 numMergedOcc 0
48 mol 234 unq 5 iso 0 dist 5.64285 6.29366 7.20293 5.52595 9.08151 11.7632 5.08515 7.77911 4.51304 9.35405 numMergedOcc 0
49 mol 267 unq 0 iso 0 dist 8.8293 7.11419 5.08174 6.74922 7.60505 9.7551 9.14203 6.27154 10.0939 4.61607 numMergedOcc 0
50 mol 267 unq 1 iso 0 dist 7.34981 6.45566 5.08174 9.163 7.60505 9.7551 8.37094 6.27154 10.0939 4.61607 numMergedOcc 0
51 mol 273 unq 0 iso 0 dist 6.31969 7.00883 9.06937 5.9476 5.4307 12.0694 7.81483 5.61969 6.2726 9.76492 numMergedOcc 0
52 mol 273 unq 1 iso 0 dist 6.31969 7.00883 9.06937 5.9476 5.4307 12.0694 7.92179 9.0277 5.33053 11.5256 numMergedOcc 0
53 mol 279 unq 0 iso 0 dist 6.35028 5.14235 8.92667 6.15987 5.81528 8.12656 12.6502 7.17958 14.9504 8.43508 numMergedOcc 0
54 mol 279 unq 1 iso 0 dist 6.35028 7.69081 6.0283 6.15987 5.81528 4.66909 12.6502 7.17958 9.09973 8.43508 numMergedOcc 0
