0 mol 19 unq 0 iso 0 dist 6.41045 8.64504 4.44441 13.3276 8.4674 10.1278 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 6.41045 8.64504 4.44441 7.64353 4.51865 7.7312 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 8.75668 8.6701 10.9873 7.26966 9.67592 14.323 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.23812 7.9575 15.0358 12.8453 9.96396 17.5767 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 7.23812 7.9575 15.0358 9.59988 6.19304 15.7053 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 7.23812 7.9575 15.0358 7.80518 8.70481 12.8223 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 5.68286 7.50229 3.68023 5.73349 7.9245 8.97888 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 9.67557 8.00314 8.37717 6.53819 7.95579 9.01812 numMergedOcc 0
8 mol 85 unq 1 iso 0 dist 9.67557 8.00314 8.37717 9.9705 6.19965 9.90583 numMergedOcc 0
9 mol 85 unq 2 iso 0 dist 9.67557 8.00314 8.37717 15.3279 7.66905 15.0494 numMergedOcc 0
10 mol 101 unq 0 iso 0 dist 8.65215 7.33426 6.2696 9.17843 6.57035 10.7342 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 9.23645 7.84707 9.18876 6.45463 9.87651 12.1816 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 9.06702 9.06707 6.45169 13.1207 9.31746 15.5145 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 9.44947 8.98633 12.2033 10.5243 7.10633 17.1555 numMergedOcc 0
14 mol 204 unq 1 iso 0 dist 9.44947 8.98633 12.2033 10.2677 8.51516 11.6168 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 6.23932 9.21286 7.35363 13.4557 9.61492 13.8425 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 6.23932 9.21286 7.35363 4.37383 7.45763 12.5568 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 6.77368 9.99638 5.17002 8.47937 6.00706 11.04 numMergedOcc 0
18 mol 222 unq 1 iso 0 dist 6.77368 9.99638 5.17002 10.4837 7.54212 10.4436 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 7.49783 7.80646 14.4014 12.8561 8.95269 16.3152 numMergedOcc 0
20 mol 248 unq 0 iso 0 dist 8.98788 9.99025 13.5822 9.01779 9.56569 17.8957 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 8.23381 6.90511 4.02333 7.48984 6.97229 5.4557 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 4.81916 9.07744 7.75371 7.94155 9.7748 5.69112 numMergedOcc 0
