0 mol 6 unq 0 iso 0 dist 8.30543 6.38732 7.54484 11.6434 11.2284 9.0451 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 8.30543 6.38732 7.54484 11.9057 13.9971 7.12528 numMergedOcc 0
2 mol 6 unq 2 iso 0 dist 9.94843 12.5999 7.54484 19.8306 11.2284 9.0451 numMergedOcc 0
3 mol 6 unq 3 iso 0 dist 9.94843 12.5999 7.54484 16.3025 13.9971 7.12528 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 9.41952 10.4376 7.80026 14.3083 5.09229 9.01601 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 7.13958 9.05571 8.85652 14.5797 11.236 6.53559 numMergedOcc 0
6 mol 129 unq 1 iso 0 dist 7.13958 9.05571 8.85652 9.0455 5.0466 8.09774 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 9.92685 12.989 9.67398 13.8116 7.43279 5.82945 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 7.17051 3.75291 5.9959 8.64946 5.57746 9.76097 numMergedOcc 0
9 mol 139 unq 0 iso 0 dist 5.77343 4.37138 7.20542 8.49892 4.94393 7.02063 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 5.28423 5.27395 6.75471 12.136 8.90456 9.81212 numMergedOcc 0
11 mol 155 unq 0 iso 0 dist 5.16143 5.05961 5.55218 6.91762 7.64573 7.25009 numMergedOcc 0
12 mol 155 unq 1 iso 0 dist 8.08392 5.68679 5.55218 12.165 7.64573 7.25009 numMergedOcc 0
13 mol 171 unq 0 iso 0 dist 6.20851 9.12839 9.67711 8.59783 5.24208 6.51523 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 8.86627 9.82173 5.77035 9.80584 4.65303 7.93715 numMergedOcc 0
15 mol 192 unq 1 iso 0 dist 9.10569 9.52963 5.77035 7.95713 4.65303 7.93715 numMergedOcc 0
16 mol 219 unq 0 iso 0 dist 7.26376 8.72864 8.3704 11.9439 7.00921 9.74779 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 7.47852 10.6169 7.50697 16.5502 10.6852 7.25438 numMergedOcc 0
18 mol 225 unq 1 iso 0 dist 6.22332 9.92088 7.50697 15.3509 10.6852 7.25438 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.29888 16.4705 9.67281 13.5486 6.31101 7.13727 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 9.29888 16.4705 9.67281 13.3705 4.13744 8.56975 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 8.06908 5.49348 8.40328 7.34794 6.92619 4.95855 numMergedOcc 0
22 mol 259 unq 1 iso 0 dist 8.06908 5.13138 8.2518 7.34794 6.92619 7.72489 numMergedOcc 0
23 mol 273 unq 0 iso 0 dist 9.80002 15.8245 6.95569 24.5116 15.6015 8.89714 numMergedOcc 0
24 mol 273 unq 1 iso 0 dist 6.73794 13.255 6.95569 21.2136 15.6015 8.89714 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 5.76796 6.01574 6.24134 8.12306 6.37482 5.09181 numMergedOcc 0
