0 mol 24 unq 0 iso 0 dist 8.83657 17.3025 9.03541 6.50335 8.69288 14.3235 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.83657 17.3025 9.03541 10.0354 7.77964 10.5945 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.74914 14.0145 9.03541 3.79072 8.69288 14.3235 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.74914 14.0145 9.03541 6.08283 7.77964 10.5945 numMergedOcc 0
4 mol 66 unq 0 iso 0 dist 6.32532 6.40505 9.00438 7.28551 9.6145 12.9761 numMergedOcc 0
5 mol 66 unq 1 iso 0 dist 6.32532 6.40505 9.00438 3.96299 8.32859 9.94694 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.25047 17.1147 9.3711 11.5226 9.08825 12.2676 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 7.65917 5.22083 8.89939 6.55929 7.20211 9.48735 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 8.37559 11.0354 6.2454 5.46771 8.16401 7.75121 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 6.6142 10.1416 9.71722 3.98194 5.42044 7.07978 numMergedOcc 0
10 mol 105 unq 0 iso 0 dist 9.84347 5.92193 9.11206 9.34708 9.17843 5.01159 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 5.4647 7.17894 6.95432 3.93042 7.86352 6.12844 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 9.22792 9.55305 7.99933 5.44287 5.67168 5.32701 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 9.7713 7.51111 5.83021 4.05534 9.95026 5.84459 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 9.7713 7.51111 5.83021 5.22561 9.09594 4.25315 numMergedOcc 0
15 mol 206 unq 2 iso 0 dist 9.7713 5.96396 9.18711 4.05534 9.95026 7.76853 numMergedOcc 0
16 mol 206 unq 3 iso 0 dist 9.7713 5.96396 9.18711 5.22561 9.09594 4.89614 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 8.79662 10.6651 4.85015 5.03056 5.72 6.84149 numMergedOcc 0
18 mol 222 unq 1 iso 0 dist 6.6497 10.6651 8.15345 5.03056 6.84052 6.84149 numMergedOcc 0
19 mol 222 unq 2 iso 0 dist 6.6497 10.6651 8.15345 3.91348 9.58086 12.7709 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 9.42801 4.99819 8.31344 12.6737 6.03081 13.0354 numMergedOcc 0
21 mol 235 unq 1 iso 0 dist 9.42801 4.99819 8.31344 8.47779 7.41433 10.4953 numMergedOcc 0
22 mol 235 unq 2 iso 0 dist 6.15704 6.25514 4.36956 9.92254 6.03081 5.39025 numMergedOcc 0
23 mol 235 unq 3 iso 0 dist 6.15704 6.25514 4.36956 5.66713 5.1874 4.3433 numMergedOcc 0
24 mol 243 unq 0 iso 0 dist 8.8602 9.60791 8.07313 3.98086 8.30024 8.17555 numMergedOcc 0
25 mol 243 unq 1 iso 0 dist 8.8602 9.60791 8.07313 4.02386 8.20943 7.40657 numMergedOcc 0
26 mol 243 unq 2 iso 0 dist 7.13476 8.07142 8.07313 4.03312 8.30024 8.17555 numMergedOcc 0
27 mol 243 unq 3 iso 0 dist 7.13476 8.07142 8.07313 9.0802 8.20943 7.40657 numMergedOcc 0
28 mol 243 unq 4 iso 0 dist 9.49016 10.8798 8.07313 12.1329 8.30024 8.17555 numMergedOcc 0
29 mol 243 unq 5 iso 0 dist 9.49016 10.8798 8.07313 6.41173 8.20943 7.40657 numMergedOcc 0
30 mol 273 unq 0 iso 0 dist 7.05843 4.87916 5.63226 5.74227 9.02537 5.35498 numMergedOcc 0
31 mol 292 unq 0 iso 0 dist 9.65996 5.49483 6.79765 6.49965 6.22943 6.37045 numMergedOcc 0
32 mol 292 unq 1 iso 0 dist 9.65996 5.49483 6.79765 12.2613 9.31056 11.9688 numMergedOcc 0
33 mol 292 unq 2 iso 0 dist 9.13412 5.49483 6.13272 6.49965 9.23612 6.37045 numMergedOcc 0
