0 mol 7 unq 0 iso 0 dist 8.41173 6.22892 6.3027 7.15287 13.8674 8.41585 12.1855 12.1296 9.87885 12.8323 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.0166 6.22805 5.70161 6.96396 12.2471 7.10621 12.2255 11.2505 9.67164 13.156 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.32945 6.22805 4.57188 6.96396 10.2729 7.10621 12.2255 13.158 9.67164 13.156 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.90117 6.22805 6.09254 6.96396 7.21217 7.10621 12.2255 14.899 9.67164 13.156 numMergedOcc 0
4 mol 16 unq 0 iso 0 dist 9.31149 9.04834 9.14256 6.05535 10.2723 4.7319 5.37568 10.6183 7.65889 6.86055 numMergedOcc 0
5 mol 16 unq 1 iso 0 dist 9.31149 8.17898 7.59626 5.72175 10.6144 5.05803 5.37568 10.6183 6.42835 5.01101 numMergedOcc 0
6 mol 16 unq 2 iso 0 dist 9.31149 8.17898 7.59626 5.72175 10.6144 5.05803 9.62324 13.7566 6.57331 4.65873 numMergedOcc 0
7 mol 64 unq 0 iso 0 dist 9.3473 9.10915 9.82646 9.73304 16.6744 9.67592 6.24019 13.5835 9.86334 5.16015 numMergedOcc 0
8 mol 64 unq 1 iso 0 dist 8.14932 8.66921 9.82646 10.8918 16.6744 9.67592 7.01498 13.5835 9.86334 5.16015 numMergedOcc 0
9 mol 64 unq 2 iso 0 dist 6.17846 8.66921 5.33496 10.8918 11.6303 9.67592 7.01498 10.3556 9.86334 5.16015 numMergedOcc 0
10 mol 64 unq 3 iso 0 dist 6.08228 5.54343 5.33496 5.59762 11.6303 9.67592 5.18166 10.3556 9.86334 5.16015 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 5.39171 6.30194 5.2774 10.5627 6.89722 6.19304 10.7557 9.71578 8.68662 6.20232 numMergedOcc 0
12 mol 73 unq 1 iso 0 dist 5.39171 6.30194 5.2774 10.5627 6.89722 6.19304 11.1632 10.1662 7.4369 5.70116 numMergedOcc 0
13 mol 73 unq 2 iso 0 dist 9.27355 6.30194 5.44275 10.5627 7.26679 6.19304 10.7557 12.3622 8.68662 6.20232 numMergedOcc 0
14 mol 73 unq 3 iso 0 dist 9.27355 6.30194 5.44275 10.5627 7.26679 6.19304 11.1632 11.4233 7.4369 5.70116 numMergedOcc 0
15 mol 73 unq 4 iso 0 dist 8.60363 6.30194 8.0624 10.5627 10.1503 6.19304 10.7557 14.4361 8.68662 6.20232 numMergedOcc 0
16 mol 73 unq 5 iso 0 dist 8.60363 6.30194 8.0624 10.5627 10.1503 6.19304 11.1632 14.3455 7.4369 5.70116 numMergedOcc 0
17 mol 127 unq 0 iso 0 dist 8.98151 8.62711 6.75619 10.345 12.4667 9.30299 9.74982 11.4732 6.08673 12.8087 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 6.68364 5.30872 5.4432 6.3915 9.32441 5.99315 5.88056 5.44814 5.37047 4.78563 numMergedOcc 0
19 mol 223 unq 0 iso 0 dist 9.29204 9.94212 18.385 11.4946 18.8401 8.77153 8.1388 15.6162 6.42257 4.04036 numMergedOcc 0
20 mol 223 unq 1 iso 0 dist 9.29204 9.94212 18.385 11.4946 18.8401 8.77153 14.288 23.4915 9.33543 13.1538 numMergedOcc 0
21 mol 223 unq 2 iso 0 dist 9.29204 9.94212 18.385 13.1422 22.2602 8.6166 8.1388 15.6162 6.42257 9.47076 numMergedOcc 0
22 mol 223 unq 3 iso 0 dist 9.29204 9.94212 18.385 13.1422 22.2602 8.6166 14.288 23.4915 9.33543 5.39728 numMergedOcc 0
23 mol 223 unq 4 iso 0 dist 9.14789 9.94212 19.0281 11.4946 19.381 8.77153 8.1388 16.4821 6.42257 4.04036 numMergedOcc 0
24 mol 223 unq 5 iso 0 dist 9.14789 9.94212 19.0281 11.4946 19.381 8.77153 14.288 22.3512 9.33543 13.1538 numMergedOcc 0
25 mol 223 unq 6 iso 0 dist 9.14789 9.94212 19.0281 13.1422 21.4312 8.6166 8.1388 16.4821 6.42257 9.47076 numMergedOcc 0
26 mol 223 unq 7 iso 0 dist 9.14789 9.94212 19.0281 13.1422 21.4312 8.6166 14.288 22.3512 9.33543 5.39728 numMergedOcc 0
27 mol 223 unq 8 iso 0 dist 7.80764 9.94212 4.67731 11.4946 12.0111 8.77153 8.1388 8.85178 6.42257 4.04036 numMergedOcc 0
28 mol 223 unq 9 iso 0 dist 7.80764 9.94212 4.67731 11.4946 12.0111 8.77153 14.288 9.73123 9.33543 13.1538 numMergedOcc 0
29 mol 223 unq 10 iso 0 dist 7.80764 9.94212 4.67731 13.1422 10.6785 8.6166 8.1388 8.85178 6.42257 9.47076 numMergedOcc 0
30 mol 223 unq 11 iso 0 dist 7.80764 9.94212 4.67731 13.1422 10.6785 8.6166 14.288 9.73123 9.33543 5.39728 numMergedOcc 0
31 mol 223 unq 12 iso 0 dist 5.75896 9.94212 7.19485 11.4946 9.5211 8.77153 8.1388 5.50267 6.42257 4.04036 numMergedOcc 0
32 mol 223 unq 13 iso 0 dist 5.75896 9.94212 7.19485 11.4946 9.5211 8.77153 14.288 15.0085 9.33543 13.1538 numMergedOcc 0
33 mol 223 unq 14 iso 0 dist 5.75896 9.94212 7.19485 13.1422 13.3416 8.6166 8.1388 5.50267 6.42257 9.47076 numMergedOcc 0
34 mol 223 unq 15 iso 0 dist 5.75896 9.94212 7.19485 13.1422 13.3416 8.6166 14.288 15.0085 9.33543 5.39728 numMergedOcc 0
35 mol 229 unq 0 iso 0 dist 8.36396 8.0007 11.2438 5.29674 12.1937 9.87838 6.80826 13.7271 6.95201 4.61227 numMergedOcc 0
36 mol 232 unq 0 iso 0 dist 5.92175 7.47238 4.90814 10.134 11.2186 8.27212 6.2559 9.11418 6.71524 5.10213 numMergedOcc 0
37 mol 239 unq 0 iso 0 dist 8.34832 9.27989 11.4465 12.1502 15.8376 6.16342 3.28983 6.64008 6.73665 10.6736 numMergedOcc 0
38 mol 248 unq 0 iso 0 dist 8.11968 6.44967 4.53213 9.48478 8.71859 7.69895 9.33595 7.90773 9.05018 4.58289 numMergedOcc 0
39 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 10.908 6.77279 8.13497 8.41608 12.5187 9.46361 12.2293 numMergedOcc 0
40 mol 259 unq 1 iso 0 dist 6.76656 6.96379 5.71237 12.7595 9.58006 7.88519 8.41608 12.5187 9.46361 11.6988 numMergedOcc 0
41 mol 276 unq 0 iso 0 dist 8.14494 5.30976 9.95911 7.38126 15.3786 9.8993 3.87012 7.11952 8.6759 9.39944 numMergedOcc 0
42 mol 276 unq 1 iso 0 dist 8.14494 5.30976 9.95911 6.39319 13.3495 6.87396 3.87012 7.11952 8.6759 8.26321 numMergedOcc 0
