0 mol 4 unq 0 iso 0 dist 6.86951 9.80478 6.56189 6.21697 6.12485 6.66589 10.4152 4.10578 4.90612 7.88748 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 5.66803 5.54343 5.9853 7.89535 13.034 9.10915 15.2562 18.8074 13.4227 9.899 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.48127 4.83274 10.6009 10.5047 11.1162 7.89214 6.97936 6.1999 6.77898 5.00466 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 8.80824 6.09472 6.80053 9.38788 15.205 8.93552 14.0812 15.4354 9.38943 9.03339 numMergedOcc 0
4 mol 115 unq 1 iso 0 dist 9.67606 6.09472 4.45342 9.38788 12.907 8.93552 14.0812 10.2911 9.38943 9.03339 numMergedOcc 0
5 mol 115 unq 2 iso 0 dist 9.41083 6.20658 4.45342 7.12394 12.907 8.93552 10.4486 10.2911 9.38943 9.03339 numMergedOcc 0
6 mol 115 unq 3 iso 0 dist 9.41083 7.83568 11.8582 7.12394 12.907 8.35604 10.4486 10.2911 5.64974 9.03339 numMergedOcc 0
7 mol 168 unq 0 iso 0 dist 9.11481 8.8573 5.06947 6.11195 7.41092 9.35182 7.337 4.66376 4.16504 9.08906 numMergedOcc 0
8 mol 168 unq 1 iso 0 dist 7.41092 9.35182 5.06947 6.11195 9.11481 8.8573 9.08906 4.66376 4.16504 7.337 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 9.86144 9.58343 12.2765 6.99846 6.39087 7.30244 13.5602 4.4227 14.9028 8.63649 numMergedOcc 0
10 mol 258 unq 0 iso 0 dist 8.70193 7.9357 4.51422 7.64421 7.25618 8.81059 16.844 11.3267 13.987 9.6327 numMergedOcc 0
11 mol 258 unq 1 iso 0 dist 8.70193 5.79537 4.99997 7.64421 7.25618 9.12006 16.844 11.3267 15.8856 9.6327 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 9.18785 8.98486 5.37435 5.69849 6.45597 7.13655 10.6454 5.19406 4.79186 6.06665 numMergedOcc 0
13 mol 287 unq 1 iso 0 dist 9.18785 8.98486 5.37435 7.02409 11.4627 8.70152 10.6454 5.19406 4.79186 9.38541 numMergedOcc 0
14 mol 287 unq 2 iso 0 dist 6.45597 7.13655 5.37435 6.44062 11.4627 8.70152 6.06665 5.19406 4.79186 9.38541 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 9.18785 8.98486 5.37435 5.69849 6.45597 7.13655 10.6454 5.19406 4.79186 6.06665 numMergedOcc 0
16 mol 288 unq 1 iso 0 dist 9.18785 8.98486 5.37435 7.02409 11.4627 8.70152 10.6454 5.19406 4.79186 9.38541 numMergedOcc 0
17 mol 288 unq 2 iso 0 dist 6.45597 7.13655 5.37435 6.44062 11.4627 8.70152 6.06665 5.19406 4.79186 9.38541 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 9.18785 8.98486 5.37435 5.69849 6.45597 7.13655 10.6454 5.19406 4.79186 6.06665 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 9.18785 8.98486 5.37435 7.02409 11.4627 8.70152 10.6454 5.19406 4.79186 9.38541 numMergedOcc 0
20 mol 289 unq 2 iso 0 dist 6.45597 7.13655 5.37435 6.44062 11.4627 8.70152 6.06665 5.19406 4.79186 9.38541 numMergedOcc 0
