0 mol 1 unq 0 iso 0 dist 8.47429 8.93702 9.45781 5.99543 12.7552 8.56884 9.35554 14.6429 9.01967 9.00903 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.98901 6.16125 4.48817 6.3236 11.2754 7.31201 12.8676 13.7984 10.789 7.10621 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 8.98901 9.34656 5.9201 15.0884 9.67996 6.36911 13.0935 11.7608 6.06176 8.41585 numMergedOcc 0
3 mol 7 unq 2 iso 0 dist 8.98901 9.34656 5.9201 6.3236 11.2754 9.36807 12.8676 13.7984 10.515 7.10621 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.90242 5.97065 5.88467 10.1933 10.2329 9.16962 12.8678 8.58243 11.887 8.34347 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 9.07029 5.97065 6.66387 10.1933 6.88695 9.16962 12.8678 5.3315 11.887 8.34347 numMergedOcc 0
6 mol 70 unq 0 iso 0 dist 9.2794 8.06918 11.9871 5.33532 13.5946 7.92394 6.77833 5.51579 6.65811 9.65964 numMergedOcc 0
7 mol 70 unq 1 iso 0 dist 9.2794 7.52623 9.5704 5.33532 13.5946 9.93423 6.77833 5.51579 5.47516 9.65964 numMergedOcc 0
8 mol 70 unq 2 iso 0 dist 9.2794 5.62294 10.9277 5.33532 13.5946 9.34122 6.77833 5.51579 11.0952 9.65964 numMergedOcc 0
9 mol 126 unq 0 iso 0 dist 8.7347 6.35364 4.56139 8.50279 8.32241 7.75534 11.0723 4.84035 7.01257 6.06638 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 5.63173 9.59094 6.2062 11.0811 10.8427 7.92688 8.95433 5.36939 4.68409 7.11802 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 5.63173 9.59094 6.2062 11.0811 10.8427 7.92688 13.7786 12.4925 12.2037 8.00618 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 9.08229 9.4422 10.9873 12.4033 15.1956 8.62646 6.53913 5.48405 6.58937 9.87651 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 7.99057 9.4422 12.2296 12.4033 18.7619 8.62646 6.53913 10.8859 6.58937 9.87651 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 8.22331 6.58245 4.40086 14.8922 11.8137 8.99696 15.5751 9.97106 9.82139 8.56633 numMergedOcc 0
15 mol 209 unq 0 iso 0 dist 6.3344 5.20111 4.45815 5.35615 10.2865 9.52027 5.92907 4.1329 6.43758 7.56373 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 9.39546 5.13604 4.8744 4.8419 12.2768 7.61951 10.5119 8.79209 7.08796 9.41367 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 4.17978 5.13604 3.90017 4.8419 7.16386 7.61951 10.5119 9.02283 7.08796 9.41367 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 5.65943 7.54327 4.21173 5.28657 7.46434 6.16063 10.4208 13.0285 11.3297 8.41436 numMergedOcc 0
19 mol 234 unq 1 iso 0 dist 5.65943 7.54327 4.21173 5.28657 7.46434 6.16063 13.7219 13.9912 10.2563 8.92474 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 6.91126 9.24964 14.9183 6.70342 9.11256 9.58736 6.45574 6.84447 9.66021 5.4638 numMergedOcc 0
21 mol 235 unq 1 iso 0 dist 9.48967 9.24964 4.28284 6.70342 7.08539 9.58736 6.45574 7.38431 9.66021 5.4638 numMergedOcc 0
22 mol 235 unq 2 iso 0 dist 6.43002 5.71896 4.28284 6.01036 7.08539 9.58736 8.14407 7.38431 9.66021 5.4638 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 5.41373 6.89216 5.98329 11.0676 11.7348 6.91569 16.8665 16.437 10.9761 6.57393 numMergedOcc 0
24 mol 248 unq 0 iso 0 dist 8.4908 7.96942 8.23532 7.63032 13.9803 8.50864 7.40475 11.014 10.1857 7.69895 numMergedOcc 0
