0 mol 58 unq 0 iso 0 dist 9.81637 11.9429 6.62496 14.7768 9.95364 8.80614 17.3046 16.3613 13.9007 7.6481 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 9.81637 11.9429 6.62496 14.7768 9.95364 8.80614 18.1713 11.5023 6.47744 9.11258 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 5.50504 7.62418 6.65721 16.6215 13.5488 9.25641 12.8314 11.7721 5.94559 7.46994 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 9.9795 9.53239 7.97049 5.20528 9.29301 9.82915 9.30804 13.9302 15.8792 6.05495 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 9.83528 12.3158 5.08437 11.7625 7.06961 6.7117 17.5729 10.417 8.70415 6.0129 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 9.83528 8.06684 6.10456 11.7625 7.06961 4.47349 17.5729 10.417 10.0962 6.0129 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 7.54969 11.7493 5.08437 9.49967 7.06961 6.7117 14.5814 10.417 8.70415 6.0129 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 7.54969 5.15322 6.10456 9.49967 7.06961 4.47349 14.5814 10.417 10.0962 6.0129 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 4.68975 9.30817 9.89303 7.85849 4.60632 7.69991 14.3338 12.7291 6.69989 8.55616 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 4.68975 9.30817 9.89303 7.85849 4.60632 7.69991 13.386 12.0514 10.1448 8.73604 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 8.84656 10.879 6.37586 7.85849 5.29786 6.23142 14.3338 10.9613 5.3585 8.55616 numMergedOcc 0
11 mol 134 unq 3 iso 0 dist 8.84656 10.879 6.37586 7.85849 5.29786 6.23142 13.386 5.42582 5.41704 8.73604 numMergedOcc 0
12 mol 134 unq 4 iso 0 dist 8.84656 16.7911 9.71307 7.85849 5.29786 9.94764 14.3338 10.9613 6.74887 8.55616 numMergedOcc 0
13 mol 134 unq 5 iso 0 dist 8.84656 16.7911 9.71307 7.85849 5.29786 9.94764 13.386 5.42582 6.17103 8.73604 numMergedOcc 0
14 mol 134 unq 6 iso 0 dist 4.9155 9.30817 6.54501 7.85849 5.71679 7.69991 14.3338 10.9685 6.69989 8.55616 numMergedOcc 0
15 mol 134 unq 7 iso 0 dist 4.9155 9.30817 6.54501 7.85849 5.71679 7.69991 13.386 8.6355 10.1448 8.73604 numMergedOcc 0
16 mol 134 unq 8 iso 0 dist 4.9155 10.879 6.49416 7.85849 5.71679 6.23142 14.3338 10.9685 5.3585 8.55616 numMergedOcc 0
17 mol 134 unq 9 iso 0 dist 4.9155 10.879 6.49416 7.85849 5.71679 6.23142 13.386 8.6355 5.41704 8.73604 numMergedOcc 0
18 mol 134 unq 10 iso 0 dist 8.49987 6.47843 6.54501 10.2775 5.71679 7.69991 12.2054 10.9685 6.69989 8.55616 numMergedOcc 0
19 mol 134 unq 11 iso 0 dist 8.49987 6.47843 6.54501 10.2775 5.71679 7.69991 15.6111 8.6355 10.1448 8.73604 numMergedOcc 0
20 mol 134 unq 12 iso 0 dist 8.49987 10.9399 6.49416 10.2775 5.71679 6.23142 12.2054 10.9685 5.3585 8.55616 numMergedOcc 0
21 mol 134 unq 13 iso 0 dist 8.49987 10.9399 6.49416 10.2775 5.71679 6.23142 15.6111 8.6355 5.41704 8.73604 numMergedOcc 0
22 mol 134 unq 14 iso 0 dist 9.42271 6.16353 6.54501 6.08299 5.71679 7.69991 5.2893 10.9685 6.69989 8.55616 numMergedOcc 0
23 mol 134 unq 15 iso 0 dist 9.42271 6.16353 6.54501 6.08299 5.71679 7.69991 11.8215 8.6355 10.1448 8.73604 numMergedOcc 0
24 mol 134 unq 16 iso 0 dist 9.42271 7.07625 6.49416 6.08299 5.71679 6.23142 5.2893 10.9685 5.3585 8.55616 numMergedOcc 0
25 mol 134 unq 17 iso 0 dist 9.42271 7.07625 6.49416 6.08299 5.71679 6.23142 11.8215 8.6355 5.41704 8.73604 numMergedOcc 0
26 mol 143 unq 0 iso 0 dist 7.73769 7.36837 5.99315 9.01311 6.48978 7.78652 5.57883 9.60643 10.0989 6.97487 numMergedOcc 0
27 mol 143 unq 1 iso 0 dist 7.73769 7.36837 5.99315 9.01311 6.48978 7.78652 6.98837 9.27292 6.01455 6.46089 numMergedOcc 0
28 mol 167 unq 0 iso 0 dist 6.53913 12.4033 9.87651 16.4519 13.0123 9.67741 17.912 15.1367 6.36909 7.80054 numMergedOcc 0
29 mol 181 unq 0 iso 0 dist 9.74465 8.42326 8.03334 12.3404 7.81713 6.2479 14.2601 12.1309 6.25083 9.06217 numMergedOcc 0
30 mol 181 unq 1 iso 0 dist 9.74465 8.42326 8.03334 12.3404 7.81713 6.2479 12.1913 12.2058 4.77278 7.13252 numMergedOcc 0
31 mol 181 unq 2 iso 0 dist 8.27794 4.89429 9.09537 10.4668 10.09 7.99195 10.0187 14.4632 5.86342 9.06217 numMergedOcc 0
32 mol 181 unq 3 iso 0 dist 8.27794 4.89429 9.09537 10.4668 10.09 7.99195 13.4037 15.4777 9.14057 7.13252 numMergedOcc 0
33 mol 232 unq 0 iso 0 dist 7.57253 9.29407 8.27212 11.059 4.9377 9.40808 18.024 11.4727 13.5597 7.17337 numMergedOcc 0
34 mol 235 unq 0 iso 0 dist 6.45574 6.70342 5.4638 4.46919 7.60081 9.55668 5.61388 8.21247 4.65302 7.95766 numMergedOcc 0
35 mol 235 unq 1 iso 0 dist 8.14407 6.01036 5.4638 9.62712 7.60081 9.55668 6.59128 8.21247 4.65302 7.95766 numMergedOcc 0
36 mol 264 unq 0 iso 0 dist 7.37999 11.0659 6.24356 13.4374 7.52936 5.93616 11.9746 9.0012 5.12409 5.91213 numMergedOcc 0
37 mol 264 unq 1 iso 0 dist 7.37999 11.0659 6.24356 13.4374 7.52936 5.93616 11.2015 9.5784 9.67998 7.34094 numMergedOcc 0
38 mol 264 unq 2 iso 0 dist 7.36703 5.91731 6.24356 10.6141 7.52936 5.93616 7.25333 9.0012 5.12409 5.91213 numMergedOcc 0
39 mol 264 unq 3 iso 0 dist 7.36703 5.91731 6.24356 10.6141 7.52936 5.93616 10.3867 9.5784 9.67998 7.34094 numMergedOcc 0
