0 mol 5 unq 0 iso 0 dist 5.14917 5.14334 9.38842 6.13766 6.93063 10.9614 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.14917 5.14334 9.38842 7.8254 7.86627 12.5157 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 8.41842 12.6461 7.99091 8.68099 7.03174 5.4503 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 5.44077 5.41731 6.76674 6.90686 5.0553 6.33492 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.29328 6.98398 8.88417 4.41292 6.07747 4.61619 numMergedOcc 0
5 mol 94 unq 0 iso 0 dist 6.91081 4.59595 9.59655 9.49883 9.82589 6.84288 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 8.56386 8.59447 9.55097 14.4087 8.74958 9.69977 numMergedOcc 0
7 mol 132 unq 0 iso 0 dist 7.16287 11.926 7.73306 14.2644 9.77766 4.6147 numMergedOcc 0
8 mol 132 unq 1 iso 0 dist 7.16287 11.926 7.73306 11.846 9.11314 6.20797 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 5.28423 5.3105 6.26222 6.73318 5.35463 6.07604 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 9.8446 7.28318 9.13163 12.0001 4.46402 9.93041 numMergedOcc 0
11 mol 165 unq 1 iso 0 dist 9.8446 16.8597 7.74717 12.0001 4.46402 8.46989 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 5.31333 7.05604 7.29651 10.9895 5.84716 9.86458 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 5.83898 5.6932 4.47148 7.19985 7.62128 10.9524 numMergedOcc 0
14 mol 215 unq 0 iso 0 dist 7.16839 7.05728 7.51339 3.87327 9.27928 5.25177 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 8.55805 10.4255 6.45234 8.78097 8.01243 11.4552 numMergedOcc 0
16 mol 220 unq 1 iso 0 dist 8.55805 10.4255 6.45234 16.8623 9.55264 8.34455 numMergedOcc 0
17 mol 254 unq 0 iso 0 dist 8.76115 14.5442 9.62779 15.1696 8.5291 9.39904 numMergedOcc 0
18 mol 254 unq 1 iso 0 dist 8.76115 14.5442 9.62779 17.6322 9.32852 13.0036 numMergedOcc 0
19 mol 254 unq 2 iso 0 dist 8.76115 13.4104 8.8044 15.1696 8.5291 9.29863 numMergedOcc 0
20 mol 254 unq 3 iso 0 dist 8.76115 13.4104 8.8044 17.6322 9.32852 8.55746 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 7.66705 10.3939 8.48012 7.06577 9.80706 8.42629 numMergedOcc 0
